data_2kdn_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2kdn _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.9 t . . . . . 0 N--CA 1.451 -0.419 0 N-CA-C 108.378 -0.971 . . . . 2.2000000000000002 108.378 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.8 tp -56.7 -35.77 46.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 120.874 0.369 . . . . 1.8200000000000001 110.855 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -65.91 -40.09 91.17 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.255 -0.429 . . . . 1.99 110.544 178.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.713 ' HZ1' ' HB2' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -61.49 -40.91 96.26 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.787 -0.642 . . . . 2.9300000000000002 110.447 -178.704 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 54.8 t -63.47 -55.38 23.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.9 -0.591 . . . . 1.6299999999999999 110.857 -178.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.7 mp -58.22 -47.42 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.112 -0.494 . . . . 1.3300000000000001 110.878 -179.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.18 -51.26 68.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.085 -0.507 . . . . 2.2000000000000002 111.121 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.713 ' HB2' ' HZ1' ' A' ' 27' ' ' LYS . 30.4 t70 -66.9 -34.51 77.94 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.479 -0.328 . . . . 1.6699999999999999 111.33 -176.104 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.802 ' HB3' ' HZ1' ' A' ' 32' ' ' LYS . 10.1 mtpm? -63.5 -55.47 23.8 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 111.836 0.31 . . . . 2.5299999999999998 111.836 -177.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.433 HD12 ' N ' ' A' ' 34' ' ' SER . 3.8 pp -70.46 -28.42 64.99 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.896 -0.322 . . . . 1.24 111.058 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.433 ' N ' HD12 ' A' ' 33' ' ' LEU . 19.6 t -65.37 -39.5 92.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.931 0.396 . . . . 1.6599999999999999 110.558 178.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.1 m -67.83 -28.07 67.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.387 -0.37 . . . . 0.79000000000000004 111.363 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.11 -54.96 3.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.309 -0.405 . . . . 1.24 111.961 -174.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.51 HD13 ' HZ ' ' A' ' 64' ' ' PHE . 65.9 mt -87.94 -16.72 33.04 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.707 0.289 . . . . 1.49 111.06 -175.263 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.5 mttp 49.55 76.39 0.55 Allowed Pre-proline 0 C--O 1.235 0.324 0 CA-C-N 115.348 -0.842 . . . . 3.8500000000000001 112.635 178.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.551 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 51.5 Cg_endo -89.27 126.68 1.64 Allowed 'Trans proline' 0 N--CA 1.447 -1.259 0 C-N-CA 122.687 2.258 . . . . 0.67000000000000004 111.769 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.3 p -63.16 -25.54 68.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.118 0.485 . . . . 1.3700000000000001 110.966 177.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.689 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 89.3 t80 -141.76 141.62 33.23 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.617 -0.72 . . . . 0.83999999999999997 109.491 175.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 45.7 tp -142.16 116.83 9.76 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.977 -0.379 . . . . 2.1899999999999999 109.977 178.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' A' ' 57' ' ' ALA . 5.7 tp10 -105.47 130.05 53.63 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 110.036 -0.357 . . . . 2.23 110.036 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.9 mp -118.44 115.8 25.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.116 0.484 . . . . 2.23 110.82 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 44.1 t -122.13 144.04 32.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.861 -0.609 . . . . 1.72 110.108 179.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -72.67 115.01 11.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.134 0.492 . . . . 1.8300000000000001 110.602 176.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.496 ' O ' ' HB2' ' A' ' 54' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.319 -0.734 0 N-CA-C 107.794 -1.187 . . . . 3.2400000000000002 107.794 174.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.496 ' HB2' ' O ' ' A' ' 47' ' ' LYS . 14.1 m . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 108.836 -0.801 . . . . 2.04 108.836 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -111.47 132.84 54.19 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.12 0.486 . . . . 1.3 110.774 -173.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.502 ' CG ' ' HZ2' ' A' ' 93' ' ' LYS . 4.2 t70 -117.48 108.72 15.86 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.319 -0.993 . . . . 1.3500000000000001 108.319 175.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.481 ' HA ' ' O ' ' A' ' 43' ' ' GLU . . . -111.15 124.91 53.13 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.14 0.495 . . . . 1.23 112.08 -171.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.481 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 58.6 t -90.02 116.74 31.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.641 -0.709 . . . . 1.1799999999999999 109.421 174.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.641 HG12 ' HA ' ' A' ' 94' ' ' CYS . 2.5 pt -97.42 145.29 9.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 121.146 0.498 . . . . 1.9399999999999999 110.77 -176.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.689 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 89.1 t -131.63 97.66 3.0 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 115.502 -0.772 . . . . 1.3700000000000001 108.939 174.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.551 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 41.9 t -144.12 138.64 28.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.321 0.582 . . . . 1.3100000000000001 112.1 -174.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.553 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 8.9 m-80 -67.66 -19.17 65.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.323 -0.853 . . . . 1.6699999999999999 111.391 174.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -61.69 -22.35 65.25 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.364 0.602 . . . . 1.8100000000000001 110.581 -178.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.642 ' CD2' ' HD2' ' A' ' 72' ' ' ARG . 13.5 m-85 -102.44 -5.91 23.55 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.943 -0.571 . . . . 3.8700000000000001 112.156 -174.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.553 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -80.92 -10.09 59.76 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.946 0.403 . . . . 2.1400000000000001 110.69 -176.85 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -75.79 -9.3 58.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.82 -0.627 . . . . 2.0299999999999998 109.817 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.451 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 2.7 mmmp? 68.55 18.6 8.88 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.169 -0.923 . . . . 3.8599999999999999 111.942 175.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.756 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 31.1 mmmt -69.5 89.79 0.52 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.347 -0.388 . . . . 2.4900000000000002 109.995 174.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -63.77 -59.67 4.26 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.742 0.306 . . . . 2.8900000000000001 110.476 -175.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.418 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.19 -31.18 71.4 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.188 -0.46 . . . . 1.6000000000000001 111.31 -177.327 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.756 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 27.0 t70 -73.91 -43.95 56.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.498 -0.319 . . . . 2.0800000000000001 110.788 -175.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.642 ' HD2' ' CD2' ' A' ' 64' ' ' PHE . 26.8 ptt180 -69.14 -31.93 70.94 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.297 -0.561 . . . . 3.4199999999999999 109.76 177.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -65.03 -49.72 69.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.152 -0.477 . . . . 1.3700000000000001 110.515 177.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.608 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 3.0 ptm180 -63.59 -40.93 98.21 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.52 -0.309 . . . . 2.1000000000000001 110.767 -179.243 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.26 -50.34 68.33 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.631 0.253 . . . . 2.1299999999999999 110.935 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.425 HG22 ' O ' ' A' ' 72' ' ' ARG . 49.2 t -56.58 -47.03 82.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.304 -0.407 . . . . 1.4099999999999999 110.94 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -66.56 -29.93 70.12 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 121.097 -0.241 . . . . 1.21 111.619 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 85.4 m -67.61 -43.91 79.31 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.865 0.364 . . . . 1.3200000000000001 111.307 -179.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.3 mp -81.29 -42.9 20.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 CA-C-O 121.331 0.586 . . . . 1.46 110.623 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.747 ' HA ' ' CB ' ' A' ' 83' ' ' GLU . 10.9 mp -73.27 -3.64 28.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.148 -0.478 . . . . 1.3799999999999999 111.129 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 45.6 tptt -51.8 -63.29 1.18 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.534 -0.543 . . . . 2.4199999999999999 109.534 169.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -75.16 -33.28 61.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.958 0.409 . . . . 2.9100000000000001 110.346 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.747 ' CB ' ' HA ' ' A' ' 80' ' ' LEU . 1.9 tp10 -54.02 -56.23 19.93 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.751 0.786 . . . . 1.6599999999999999 111.727 -176.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 57.5 mt -50.25 -30.95 12.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.243 -1.344 . . . . 1.27 112.882 177.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -54.76 -24.43 22.43 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.031 0.378 . . . . 0.96999999999999997 111.608 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -102.6 -0.02 32.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.553 -0.294 . . . . 1.02 111.75 -176.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 8.3 mt -126.13 139.88 50.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.683 0.278 . . . . 1.3100000000000001 110.383 -176.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 50.0 t60 -70.37 -42.19 72.11 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.804 -0.443 . . . . 2.29 109.804 175.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.416 ' O ' ' HB3' ' A' ' 54' ' ' SER . . . -157.54 111.6 2.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.159 -0.473 . . . . 1.3999999999999999 110.629 177.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -103.11 121.87 43.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.387 -0.369 . . . . 0.63 110.504 176.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.3 m -111.33 147.32 35.37 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.754 -0.657 . . . . 1.9399999999999999 109.494 177.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -135.82 142.17 44.81 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.013 0.435 . . . . 1.27 111.433 -178.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.502 ' HZ2' ' CG ' ' A' ' 56' ' ' ASP . 13.6 mptt -109.49 112.98 25.39 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.291 -0.633 . . . . 2.71 109.291 173.196 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.641 ' HA ' HG12 ' A' ' 59' ' ' ILE . 5.7 p -83.54 116.22 22.47 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.923 -0.581 . . . . 2.0 111.224 -175.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -143.62 166.95 23.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.29 0.566 . . . . 2.6099999999999999 111.372 176.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.435 HG22 ' HB3' ' A' ' 65' ' ' GLU . 22.0 p -113.87 163.32 19.07 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 115.544 -0.753 . . . . 1.27 110.901 -179.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . 0.505 ' HG2' ' ND2' ' A' ' 62' ' ' ASN . 31.4 Cg_exo -60.95 -24.0 78.52 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.759 2.306 . . . . 1.0900000000000001 111.899 177.396 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -66.44 -49.35 67.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.844 -0.616 . . . . 2.6200000000000001 110.032 178.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.526 ' HA ' ' HD3' ' A' ' 102' ' ' LYS . 34.4 mt-10 -76.96 -30.44 56.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.071 -0.513 . . . . 2.6899999999999999 110.682 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 52.0 t80 -66.88 -41.45 87.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.435 -0.348 . . . . 1.6100000000000001 110.976 177.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -57.13 -38.14 73.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.027 0.442 . . . . 1.23 110.77 178.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.526 ' HD3' ' HA ' ' A' ' 99' ' ' GLU . 15.2 mtpp -58.07 -48.05 81.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.852 -0.613 . . . . 3.1499999999999999 110.558 178.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 53.2 mt . . . . . 0 C--N 1.323 -0.561 0 CA-C-N 115.85 -0.614 . . . . 1.5900000000000001 111.682 -175.85 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.564 ' O ' HG21 ' A' ' 28' ' ' VAL . 21.3 t . . . . . 0 N--CA 1.453 -0.319 0 N-CA-C 109.591 -0.522 . . . . 2.2000000000000002 109.591 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.0 tp -57.06 -38.65 61.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 O-C-N 123.242 0.339 . . . . 1.8200000000000001 111.088 -176.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -61.68 -43.86 98.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.928 0.394 . . . . 1.99 110.279 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -71.27 -26.3 62.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.122 -0.49 . . . . 2.9300000000000002 111.01 -177.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.564 HG21 ' O ' ' A' ' 24' ' ' CYS . 91.2 t -61.76 -53.86 42.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.367 -0.379 . . . . 1.6299999999999999 110.19 176.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.48 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.8 mp -61.17 -43.76 97.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.784 -0.644 . . . . 1.3300000000000001 110.228 178.424 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -52.67 -51.81 58.56 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 116.028 -0.533 . . . . 2.2000000000000002 111.769 178.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -69.69 -30.93 68.7 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.283 0.563 . . . . 1.6699999999999999 110.684 -177.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 31.1 tttm -68.57 -54.48 16.35 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.378 -0.828 . . . . 2.5299999999999998 111.065 -176.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 3.9 pp -71.92 -27.04 62.55 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 120.757 -0.377 . . . . 1.24 111.048 176.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.457 ' N ' HD12 ' A' ' 33' ' ' LEU . 44.3 t -61.93 -44.04 97.6 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-O 120.805 0.336 . . . . 1.6599999999999999 110.226 176.301 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.2 m -64.22 -27.37 69.01 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.327 -0.397 . . . . 0.79000000000000004 110.965 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.86 -54.43 5.6 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.093 0.405 . . . . 1.24 112.093 -177.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.0 mt -97.07 -35.59 10.77 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.867 0.365 . . . . 1.49 111.725 -174.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.492 ' HA ' ' HD3' ' A' ' 38' ' ' LYS . 31.8 mmtt 58.15 87.29 0.14 Allowed Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.364 -0.835 . . . . 3.8500000000000001 112.862 -177.631 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.777 ' HB3' HG12 ' A' ' 59' ' ' ILE . 73.7 Cg_endo -82.91 137.62 8.77 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 122.62 2.213 . . . . 0.67000000000000004 111.34 171.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 33.4 p -77.54 -23.89 50.01 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.42 0.629 . . . . 1.3700000000000001 109.695 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.605 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 83.9 t80 -136.3 124.05 22.5 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.123 -0.944 . . . . 0.83999999999999997 109.176 172.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.41 HD12 ' O ' ' A' ' 58' ' ' VAL . 56.7 tp -134.9 113.86 11.97 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.432 -0.349 . . . . 2.1899999999999999 110.337 -177.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -120.37 124.85 46.54 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.385 -0.371 . . . . 2.23 110.974 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 67.1 mt -86.4 122.16 29.97 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.172 0.511 . . . . 2.23 110.787 175.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 67.6 t -106.96 111.09 34.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.479 -0.782 . . . . 1.72 109.05 175.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -69.28 102.11 1.65 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.994 -0.548 . . . . 1.8300000000000001 109.977 -177.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 36.2 mmtm . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 116.046 -0.525 . . . . 3.2400000000000002 111.05 -177.568 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.3 m . . . . . 0 N--CA 1.452 -0.372 0 CA-C-O 120.906 0.384 . . . . 2.04 110.993 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -111.43 138.69 47.61 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.091 -0.504 . . . . 1.3 110.384 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -116.54 123.02 46.38 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.24 -0.652 . . . . 1.3500000000000001 109.24 176.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.98 115.74 30.74 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.863 0.363 . . . . 1.23 110.899 -176.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.754 HG21 ' HE2' ' A' ' 93' ' ' LYS . 38.3 t -81.07 110.95 17.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 108.621 -0.881 . . . . 1.1799999999999999 108.621 173.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.777 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -111.53 107.7 23.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 CA-C-O 121.679 0.752 . . . . 1.9399999999999999 110.485 -174.011 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.613 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 58.0 t -104.58 106.64 20.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 CA-C-N 114.94 -1.027 . . . . 1.3700000000000001 108.464 174.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.655 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 32.7 t -142.84 147.43 35.41 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.755 0.65 . . . . 1.3100000000000001 112.755 -170.243 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.471 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 0.6 OUTLIER -64.09 -22.19 66.83 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 114.988 -1.006 . . . . 1.6699999999999999 110.829 173.258 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -63.35 -35.62 81.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.188 0.518 . . . . 1.8100000000000001 110.417 -177.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.409 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 27.2 t80 -100.49 12.04 38.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.318 0.58 . . . . 3.8700000000000001 110.118 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.471 ' HB3' ' O ' ' A' ' 62' ' ' ASN . 2.2 tp10 -81.31 -28.55 34.55 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 108.087 -1.079 . . . . 2.1400000000000001 108.087 176.232 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.596 ' OD2' ' HG3' ' A' ' 68' ' ' LYS . 21.0 t70 -57.32 -41.13 79.33 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 108.293 -1.003 . . . . 2.0299999999999998 108.293 166.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.0 ttpm? 75.59 25.02 1.25 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 114.476 -1.238 . . . . 3.8599999999999999 113.161 161.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.596 ' HG3' ' OD2' ' A' ' 66' ' ' ASP . 36.7 mtmm -74.76 122.53 23.44 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 121.97 -0.456 . . . . 2.4900000000000002 109.959 169.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.5 pp -74.0 -32.18 63.28 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.772 -0.371 . . . . 2.8900000000000001 110.953 -175.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.482 HD11 ' HB3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -67.72 -30.81 70.4 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.038 0.447 . . . . 1.6000000000000001 110.417 177.32 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.443 ' HB2' ' HE2' ' A' ' 68' ' ' LYS . 36.0 t70 -72.62 -36.91 68.16 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.155 0.502 . . . . 2.0800000000000001 109.658 179.49 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.409 ' HB2' ' CE1' ' A' ' 64' ' ' PHE . 48.3 ttt-85 -57.77 -47.25 83.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.496 -0.775 . . . . 3.4199999999999999 109.563 172.309 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -57.22 -54.46 46.5 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.143 -0.935 . . . . 1.3700000000000001 111.28 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.426 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 13.2 ptm180 -70.7 -46.42 63.15 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.285 0.476 . . . . 2.1000000000000001 112.285 -172.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 75' ' ' LEU . 27.3 mt -63.08 -45.97 89.63 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 111.759 0.281 . . . . 2.1299999999999999 111.759 -176.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.539 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 58.7 t -58.05 -48.25 84.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.57 -0.286 . . . . 1.4099999999999999 110.487 179.002 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -66.58 -31.7 72.57 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.687 -0.405 . . . . 1.21 111.564 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 99.2 m -61.71 -61.41 2.53 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.655 0.242 . . . . 1.3200000000000001 111.655 -178.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.5 mp -75.95 -43.8 38.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-O 121.071 0.463 . . . . 1.46 110.833 -176.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.777 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.4 mp -77.65 -7.55 56.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.903 -0.59 . . . . 1.3799999999999999 112.338 -171.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -50.13 -62.55 1.51 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.277 0.56 . . . . 2.4199999999999999 109.9 171.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -75.15 -33.52 61.53 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.448 -0.796 . . . . 2.9100000000000001 110.708 177.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.777 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.3 tp10 -56.29 -53.53 56.21 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.477 0.656 . . . . 1.6599999999999999 112.026 -176.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.663 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 66.3 mt -50.72 -30.44 13.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.711 -1.131 . . . . 1.27 112.505 179.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -53.5 -27.36 25.07 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.046 0.451 . . . . 0.96999999999999997 111.038 -178.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -87.0 -6.78 58.64 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.804 -0.634 . . . . 1.02 111.701 -175.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.469 HD12 ' HB2' ' A' ' 90' ' ' PHE . 3.2 mt -125.52 160.36 31.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 109.969 -0.382 . . . . 1.3100000000000001 109.969 -176.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -79.36 -54.82 5.56 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.421 -0.585 . . . . 2.29 109.421 174.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -145.26 115.59 7.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.828 -0.624 . . . . 1.3999999999999999 110.176 177.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . 0.469 ' HB2' HD12 ' A' ' 87' ' ' ILE . 86.2 t80 -108.4 129.19 55.26 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.161 0.505 . . . . 0.63 110.605 177.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 38.2 t -115.02 146.76 40.93 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.267 -0.879 . . . . 1.9399999999999999 109.25 177.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -129.3 130.69 46.48 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.929 0.395 . . . . 1.27 110.417 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.754 ' HE2' HG21 ' A' ' 58' ' ' VAL . 2.3 ttmm -113.7 109.01 17.9 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.864 -0.791 . . . . 2.71 108.864 176.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.504 ' HA ' HG21 ' A' ' 59' ' ' ILE . 13.2 p -92.16 140.9 29.17 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.934 0.397 . . . . 2.0 111.358 -172.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.613 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 8.7 t60 -153.65 154.43 34.16 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.939 -0.573 . . . . 2.6099999999999999 109.712 177.414 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.417 ' CG2' ' HA ' ' A' ' 65' ' ' GLU . 1.3 p -96.6 148.79 34.97 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 121.042 0.449 . . . . 1.27 112.093 -177.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -67.87 -35.34 21.31 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 123.255 2.637 . . . . 1.0900000000000001 113.075 -176.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.4 -48.22 82.46 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.112 0.482 . . . . 2.6200000000000001 110.225 179.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -66.24 -33.78 76.52 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.623 -0.717 . . . . 2.6899999999999999 111.012 177.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 49.7 t80 -69.83 -33.99 73.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.469 -0.332 . . . . 1.6100000000000001 111.4 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -58.08 -35.15 70.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.94 0.4 . . . . 1.23 111.087 -178.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.701 ' HE2' ' N ' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -74.91 -29.35 60.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.907 0.384 . . . . 3.1499999999999999 110.378 178.528 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 89.7 mt . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 115.941 -0.572 . . . . 1.5900000000000001 110.67 179.19 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 32.3 m . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 120.534 0.206 . . . . 2.2000000000000002 110.74 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.3 tp -57.2 -34.04 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-O 121.178 0.513 . . . . 1.8200000000000001 110.925 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -65.52 -38.89 91.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.104 -0.498 . . . . 1.99 110.922 178.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.696 ' HA ' ' HE3' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -68.4 -46.57 69.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.093 -0.503 . . . . 2.9300000000000002 111.193 -175.615 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.51 ' O ' ' HG2' ' A' ' 32' ' ' LYS . 5.3 p -64.87 -46.04 93.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 C-N-CA 120.833 -0.347 . . . . 1.6299999999999999 111.163 -177.445 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.454 HD13 HG12 ' A' ' 28' ' ' VAL . 1.7 mp -60.71 -47.62 92.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-O 121.033 0.444 . . . . 1.3300000000000001 110.721 178.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.64 -42.02 91.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.326 -0.397 . . . . 2.2000000000000002 110.77 -178.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -68.04 -35.4 78.2 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.167 -0.47 . . . . 1.6699999999999999 111.423 -175.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' A' ' 28' ' ' VAL . 74.1 mmtt -65.06 -55.61 17.84 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.935 0.398 . . . . 2.5299999999999998 111.067 -178.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.488 HD11 ' N ' ' A' ' 34' ' ' SER . 3.3 pp -71.81 -28.9 63.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.126 -0.488 . . . . 1.24 112.135 -174.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.488 ' N ' HD11 ' A' ' 33' ' ' LEU . 69.7 m -69.23 -43.05 74.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.769 0.319 . . . . 1.6599999999999999 110.97 179.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.7 m -71.3 -27.45 63.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.1 0.476 . . . . 0.79000000000000004 111.076 -178.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.65 -54.94 4.0 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.032 0.382 . . . . 1.24 112.032 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.1 mt -81.85 -32.04 31.33 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.848 0.314 . . . . 1.49 111.848 -173.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm 65.16 74.77 0.38 Allowed Pre-proline 0 N--CA 1.468 0.456 0 O-C-N 123.595 0.559 . . . . 3.8500000000000001 110.99 -175.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.675 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 63.0 Cg_endo -88.66 134.76 2.83 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 122.289 1.993 . . . . 0.67000000000000004 112.374 176.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 30.4 p -68.86 -30.56 69.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.276 0.56 . . . . 1.3700000000000001 109.64 175.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.667 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 86.3 t80 -141.91 134.27 27.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.325 -0.852 . . . . 0.83999999999999997 109.262 174.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -142.24 126.16 17.19 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.547 -0.538 . . . . 2.1899999999999999 109.547 -178.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -137.48 127.79 26.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.889 0.375 . . . . 2.23 110.934 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.41 ' N ' HD22 ' A' ' 44' ' ' LEU . 2.5 mm? -90.61 115.76 27.98 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.368 -0.604 . . . . 2.23 109.368 177.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 52.5 t -109.08 118.25 56.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.901 0.382 . . . . 1.72 110.769 -178.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -91.19 123.64 34.79 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.108 -0.701 . . . . 1.8300000000000001 109.108 173.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 60.6 tttp . . . . . 0 C--N 1.322 -0.591 0 CA-C-O 120.791 0.329 . . . . 3.2400000000000002 110.857 -179.752 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 62.3 m . . . . . 0 N--CA 1.45 -0.443 0 N-CA-C 109.109 -0.701 . . . . 2.04 109.109 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -111.39 137.6 48.96 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.597 -0.274 . . . . 1.3 110.82 -176.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -102.18 110.23 22.13 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.754 -1.202 . . . . 1.3500000000000001 107.754 168.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.77 117.53 34.25 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 120.899 0.38 . . . . 1.23 111.268 -171.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.7 t -73.39 111.27 7.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 109.026 -0.731 . . . . 1.1799999999999999 109.026 176.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -106.87 107.81 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 CA-C-O 121.774 0.797 . . . . 1.9399999999999999 109.571 -178.313 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.667 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 58.7 t -108.21 103.97 16.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.108 -0.951 . . . . 1.3700000000000001 108.971 177.087 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.675 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 29.0 t -145.26 153.27 41.13 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.986 0.422 . . . . 1.3100000000000001 111.291 -175.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.733 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 22.9 m120 -67.44 -19.21 65.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.486 -0.779 . . . . 1.6699999999999999 110.477 175.083 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -63.65 -18.97 64.5 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.236 0.541 . . . . 1.8100000000000001 110.384 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.609 ' HD2' HG23 ' A' ' 96' ' ' THR . 62.9 t80 -93.46 -19.8 20.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 3.8700000000000001 111.561 -178.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.733 ' HG2' ' O ' ' A' ' 62' ' ' ASN . 11.9 pt-20 -71.23 -20.06 62.29 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.627 -0.429 . . . . 2.1400000000000001 110.474 -176.318 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.582 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . 17.2 m-20 -69.15 -20.48 64.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.029 -0.532 . . . . 2.0299999999999998 110.581 175.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.11 19.74 11.89 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.453 -0.794 . . . . 3.8599999999999999 110.777 177.222 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.582 ' HG2' ' HB3' ' A' ' 66' ' ' ASP . 31.3 mmmt -79.54 102.63 8.95 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.907 -0.588 . . . . 2.4900000000000002 110.323 -178.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.403 HD12 ' N ' ' A' ' 70' ' ' LEU . 3.7 pp -67.55 -44.22 78.8 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.324 -0.398 . . . . 2.8900000000000001 110.767 -177.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.41 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.73 -31.24 71.04 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.49 -0.323 . . . . 1.6000000000000001 111.254 -178.972 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.679 ' HA ' ' HD2' ' A' ' 74' ' ' ARG . 4.8 m-20 -73.55 -44.77 56.68 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 121.094 -0.242 . . . . 2.0800000000000001 111.345 -178.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 18.3 ptt180 -67.89 -31.93 72.07 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.909 -0.716 . . . . 3.4199999999999999 109.82 176.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -64.03 -50.97 66.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.071 -0.513 . . . . 1.3700000000000001 110.521 176.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.679 ' HD2' ' HA ' ' A' ' 71' ' ' ASP . 5.0 ptm180 -63.57 -39.55 94.68 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.399 -0.364 . . . . 2.1000000000000001 110.836 -177.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -66.48 -51.84 52.48 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.723 0.297 . . . . 2.1299999999999999 111.046 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.69 HG11 HD21 ' A' ' 80' ' ' LEU . 45.6 t -57.74 -45.69 86.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.065 -0.516 . . . . 1.4099999999999999 110.978 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.537 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 12.7 m120 -62.73 -42.01 99.45 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.475 -0.49 . . . . 1.21 111.262 -178.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.444 ' HB ' HD13 ' A' ' 79' ' ' ILE . 89.3 m -58.76 -54.67 44.44 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.113 0.412 . . . . 1.3200000000000001 112.113 -175.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.444 HD13 ' HB ' ' A' ' 78' ' ' THR . 4.3 mp -88.01 -48.51 15.04 Favored 'Isoleucine or valine' 0 C--O 1.242 0.663 0 CA-C-O 121.643 0.735 . . . . 1.46 111.016 -175.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.776 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 7.7 mp -73.31 -4.37 32.82 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.654 -0.703 . . . . 1.3799999999999999 111.668 -173.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.537 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 17.6 tppt? -55.72 -60.0 4.07 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.358 -0.608 . . . . 2.4199999999999999 109.358 168.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.434 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 6.9 mm-40 -67.72 -32.94 73.91 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.65 -0.705 . . . . 2.9100000000000001 110.261 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.635 ' CB ' ' HA ' ' A' ' 80' ' ' LEU . 2.6 tp10 -54.59 -55.35 30.35 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.815 -0.63 . . . . 1.6599999999999999 111.054 176.187 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.776 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 56.3 mt -51.03 -30.58 15.88 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.273 -0.876 . . . . 1.27 112.46 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.434 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 23.1 mm-40 -54.41 -25.52 25.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.64 0.257 . . . . 0.96999999999999997 111.436 -176.471 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -106.63 8.28 31.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.716 0.293 . . . . 1.02 111.326 -177.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 11.2 mt -129.35 155.81 41.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 109.635 -0.506 . . . . 1.3100000000000001 109.635 -178.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -86.9 -61.11 1.8 Allowed 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.414 -0.514 . . . . 2.29 109.778 175.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -137.85 95.15 2.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.056 0.455 . . . . 1.3999999999999999 110.99 178.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -84.68 119.63 25.47 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.018 -0.537 . . . . 0.63 110.204 176.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 38.0 m -112.42 157.13 21.43 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.556 -0.535 . . . . 1.9399999999999999 109.556 177.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -134.97 137.78 43.38 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.96 0.409 . . . . 1.27 110.655 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.686 ' HZ3' ' HB2' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -103.12 109.0 20.41 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.338 -0.986 . . . . 2.71 108.338 176.175 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.7 m -88.08 127.84 35.41 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 111.837 0.31 . . . . 2.0 111.837 -169.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.612 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 73.0 m-70 -148.42 160.95 42.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.108 0.48 . . . . 2.6099999999999999 110.668 174.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.609 HG23 ' HD2' ' A' ' 64' ' ' PHE . 22.6 p -108.44 159.42 30.87 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.771 -0.65 . . . . 1.27 110.697 176.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -59.26 -26.35 81.5 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.594 2.196 . . . . 1.0900000000000001 111.834 176.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -62.9 -49.78 73.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.012 -0.54 . . . . 2.6200000000000001 109.961 176.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.469 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 30.5 mt-10 -60.4 -47.71 84.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.873 -0.603 . . . . 2.6899999999999999 110.313 176.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -60.43 -39.16 86.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.617 -0.72 . . . . 1.6100000000000001 111.087 -177.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -60.78 -37.68 82.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.954 0.407 . . . . 1.23 110.772 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.544 ' HE2' ' N ' ' A' ' 102' ' ' LYS . 0.3 OUTLIER -71.92 -32.35 67.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.138 -0.483 . . . . 3.1499999999999999 110.362 178.6 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 85.7 mt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.071 -0.513 . . . . 1.5900000000000001 110.83 177.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 84.5 m . . . . . 0 C--O 1.232 0.171 0 CA-C-O 120.734 0.302 . . . . 2.2000000000000002 110.884 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 10.1 tp -59.48 -30.06 43.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.931 -0.577 . . . . 1.8200000000000001 110.948 -178.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -60.31 -43.41 96.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.198 -0.455 . . . . 1.99 110.437 177.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.547 ' HE3' ' HB2' ' A' ' 31' ' ' ASP . 38.8 tptt -67.5 -36.92 82.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.956 -0.565 . . . . 2.9300000000000002 110.843 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 61.3 t -57.91 -52.24 60.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.061 0.457 . . . . 1.6299999999999999 110.589 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.442 HG13 ' HG3' ' A' ' 83' ' ' GLU . 1.8 mp -64.35 -47.34 90.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.808 -0.633 . . . . 1.3300000000000001 110.542 178.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -54.81 -52.05 63.9 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 116.218 -0.446 . . . . 2.2000000000000002 110.892 -179.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.547 ' HB2' ' HE3' ' A' ' 27' ' ' LYS . 10.6 t70 -66.07 -31.09 71.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.245 -0.434 . . . . 1.6699999999999999 110.971 -174.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 52.3 tptt -70.15 -55.63 8.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.517 -0.31 . . . . 2.5299999999999998 111.258 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.508 HD13 ' N ' ' A' ' 34' ' ' SER . 3.9 pp -71.47 -26.32 62.66 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.894 -0.322 . . . . 1.24 111.168 -178.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.508 ' N ' HD13 ' A' ' 33' ' ' LEU . 9.5 t -66.77 -42.24 86.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.94 0.4 . . . . 1.6599999999999999 110.132 178.225 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 26.3 m -71.59 -27.07 62.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.12 0.486 . . . . 0.79000000000000004 111.027 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.79 -52.2 7.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.121 -0.49 . . . . 1.24 111.615 -178.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.2 mt -83.65 -42.09 17.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.504 -0.316 . . . . 1.49 111.23 -176.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 56.92 83.94 0.22 Allowed Pre-proline 0 N--CA 1.464 0.227 0 CA-C-O 121.694 0.759 . . . . 3.8500000000000001 111.436 -175.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.71 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 74.2 Cg_endo -92.24 151.47 3.11 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 123.271 2.647 . . . . 0.67000000000000004 112.991 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.7 p -76.95 -27.24 54.75 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.419 0.628 . . . . 1.3700000000000001 109.958 175.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.772 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 88.6 t80 -141.73 132.52 25.74 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.336 -0.847 . . . . 0.83999999999999997 109.082 173.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.519 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 60.0 tp -142.38 121.42 12.89 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 110.317 -0.253 . . . . 2.1899999999999999 110.317 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -124.4 115.83 21.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.065 0.46 . . . . 2.23 110.78 178.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -85.94 115.5 23.6 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.135 -0.691 . . . . 2.23 109.135 174.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.568 HG13 ' HG3' ' A' ' 47' ' ' LYS . 19.8 t -106.13 113.56 43.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 120.913 0.387 . . . . 1.72 110.711 -177.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -72.66 106.08 4.53 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.937 -0.574 . . . . 1.8300000000000001 110.042 175.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.568 ' HG3' HG13 ' A' ' 45' ' ' VAL . 56.4 mtmt . . . . . 0 C--N 1.321 -0.648 0 CA-C-N 115.816 -0.629 . . . . 3.2400000000000002 109.706 177.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.404 ' HA ' ' O ' ' A' ' 89' ' ' ALA . 25.0 p . . . . . 0 N--CA 1.451 -0.39 0 CA-C-O 120.894 0.378 . . . . 2.04 110.384 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -124.96 137.69 54.25 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.176 -0.466 . . . . 1.3 110.442 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.421 ' CG ' ' HZ2' ' A' ' 93' ' ' LYS . 23.1 t0 -114.68 122.04 45.23 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.831 -0.622 . . . . 1.3500000000000001 109.519 178.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -107.11 115.99 31.14 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.911 0.386 . . . . 1.23 111.861 -174.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.2 t -83.25 111.76 19.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.19 -0.67 . . . . 1.1799999999999999 109.19 173.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -111.97 115.09 48.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.646 0.736 . . . . 1.9399999999999999 110.594 -174.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.772 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 74.7 t -114.49 106.83 21.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.013 -0.994 . . . . 1.3700000000000001 109.411 176.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.71 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 42.5 t -146.7 153.01 39.76 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.87 0.692 . . . . 1.3100000000000001 112.87 -173.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.442 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 12.4 m120 -67.31 -22.0 65.64 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.109 -0.95 . . . . 1.6699999999999999 110.518 172.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -65.57 -24.04 66.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.293 0.568 . . . . 1.8100000000000001 110.13 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.444 ' CE1' ' HD3' ' A' ' 72' ' ' ARG . 71.0 t80 -103.06 -2.93 26.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.683 -0.69 . . . . 3.8700000000000001 110.449 178.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.442 ' HB3' ' HA ' ' A' ' 62' ' ' ASN . 0.9 OUTLIER -72.49 -33.18 66.77 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.584 -0.525 . . . . 2.1400000000000001 109.584 -175.157 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.641 ' OD2' ' HD3' ' A' ' 68' ' ' LYS . 3.1 t70 -63.6 -14.41 51.29 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.716 -0.476 . . . . 2.0299999999999998 109.716 176.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 30.6 mtmm 63.25 50.08 3.09 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.159 -0.928 . . . . 3.8599999999999999 111.458 174.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.641 ' HD3' ' OD2' ' A' ' 66' ' ' ASP . 30.5 mmmt -89.37 96.09 10.56 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.091 -0.959 . . . . 2.4900000000000002 110.527 179.256 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 46.9 tp -55.69 -64.31 0.89 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.018 -0.537 . . . . 2.8900000000000001 111.741 -178.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.92 -31.01 71.69 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.211 -0.449 . . . . 1.6000000000000001 111.46 -175.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.554 ' HB2' ' HB3' ' A' ' 68' ' ' LYS . 23.3 m-20 -73.59 -36.42 65.54 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.844 0.313 . . . . 2.0800000000000001 111.844 -176.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.444 ' HD3' ' CE1' ' A' ' 64' ' ' PHE . 25.0 ptt85 -69.9 -32.93 71.52 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 119.891 -0.724 . . . . 3.4199999999999999 109.393 175.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -64.73 -49.36 71.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.693 -0.685 . . . . 1.3700000000000001 110.231 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.517 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 4.2 ptm180 -69.57 -40.51 76.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.864 -0.607 . . . . 2.1000000000000001 111.508 -178.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 35.9 tp -64.96 -47.2 78.46 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.732 0.301 . . . . 2.1299999999999999 110.743 -177.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.614 HG11 HD23 ' A' ' 80' ' ' LEU . 37.2 t -57.31 -48.32 82.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.98 -0.554 . . . . 1.4099999999999999 110.701 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -61.19 -33.58 73.69 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.652 -0.249 . . . . 1.21 111.533 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 95.9 m -63.62 -56.16 17.97 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 111.804 0.298 . . . . 1.3200000000000001 111.804 -178.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.2 mp -76.78 -46.84 29.62 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 CA-C-O 121.317 0.58 . . . . 1.46 110.744 -178.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.932 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 9.1 mp -73.16 -3.6 27.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.879 -0.6 . . . . 1.3799999999999999 111.589 -175.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 48.0 tptt -50.64 -63.69 1.04 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.635 -0.506 . . . . 2.4199999999999999 109.635 170.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -75.07 -36.49 61.77 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.417 -0.356 . . . . 2.9100000000000001 110.622 177.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.932 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 34.4 tt0 -57.09 -45.32 83.45 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.349 -0.387 . . . . 1.6599999999999999 111.895 -176.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 42.4 mt -56.81 -30.78 64.05 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.471 0.545 . . . . 1.27 112.471 -177.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -54.93 -24.57 24.3 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 120.857 0.36 . . . . 0.96999999999999997 111.5 -174.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -91.44 -4.78 55.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.247 -0.433 . . . . 1.02 111.129 -175.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.415 HD12 HG12 ' A' ' 29' ' ' ILE . 6.0 mt -124.25 137.65 56.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.444 -0.344 . . . . 1.3100000000000001 110.187 -176.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -75.96 -47.72 23.95 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.626 -0.509 . . . . 2.29 109.626 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.404 ' O ' ' HA ' ' A' ' 54' ' ' SER . . . -141.23 96.65 3.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.987 0.423 . . . . 1.3999999999999999 111.217 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -92.79 144.61 25.12 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.167 -0.469 . . . . 0.63 110.155 175.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 50.0 m -135.51 162.09 33.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.188 -0.46 . . . . 1.9399999999999999 109.773 175.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -144.95 148.87 34.31 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.976 0.417 . . . . 1.27 110.845 -178.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.421 ' HZ2' ' CG ' ' A' ' 56' ' ' ASP . 44.2 mmtm -125.34 109.09 12.36 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.798 -0.816 . . . . 2.71 108.798 174.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 7.9 p -93.78 124.75 37.99 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.721 0.296 . . . . 2.0 111.688 -173.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.485 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 22.1 m-70 -147.95 174.19 12.13 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 121.183 0.516 . . . . 2.6099999999999999 111.122 176.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.688 ' HB ' ' HD2' ' A' ' 97' ' ' PRO . 72.2 p -116.46 164.3 18.8 Favored Pre-proline 0 C--O 1.243 0.746 0 CA-C-N 116.014 -0.539 . . . . 1.27 111.451 -177.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . 0.688 ' HD2' ' HB ' ' A' ' 96' ' ' THR . 14.5 Cg_endo -57.69 -20.75 44.1 Favored 'Trans proline' 0 C--O 1.219 -0.425 0 C-N-CA 122.826 2.35 . . . . 1.0900000000000001 112.138 178.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.548 ' O ' ' HD2' ' A' ' 102' ' ' LYS . 4.0 mm? -62.46 -51.15 68.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.706 0.289 . . . . 2.6200000000000001 110.236 177.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.564 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 3.4 mp0 -61.54 -46.32 90.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.398 . . . . 2.6899999999999999 110.567 177.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -67.03 -42.49 84.78 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.517 -0.473 . . . . 1.6100000000000001 111.75 -177.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -64.87 -33.04 75.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.855 0.36 . . . . 1.23 110.45 -178.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.548 ' HD2' ' O ' ' A' ' 98' ' ' LEU . 1.1 mpmm? -73.9 -20.3 60.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.518 -0.31 . . . . 3.1499999999999999 110.978 177.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 82.1 mt . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 121.082 0.468 . . . . 1.5900000000000001 109.915 174.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.483 ' O ' HG23 ' A' ' 28' ' ' VAL . 53.5 t . . . . . 0 N--CA 1.458 -0.048 0 N-CA-C 109.731 -0.47 . . . . 2.2000000000000002 109.731 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.521 HD13 ' HB3' ' A' ' 86' ' ' ASN . 6.3 tp -49.49 -47.74 20.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 N-CA-C 112.19 0.441 . . . . 1.8200000000000001 112.19 -175.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -63.72 -44.08 94.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.802 0.334 . . . . 1.99 110.322 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.462 ' HZ3' ' CD ' ' A' ' 30' ' ' GLU . 30.6 mmmt -64.73 -36.02 82.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.923 -0.58 . . . . 2.9300000000000002 111.235 -178.54 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 24' ' ' CYS . 95.6 t -58.87 -55.54 22.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 N-CA-C 110.37 -0.233 . . . . 1.6299999999999999 110.37 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.416 HG23 HD11 ' A' ' 87' ' ' ILE . 1.9 mp -66.19 -42.19 90.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.894 0.378 . . . . 1.3300000000000001 110.586 -179.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.462 ' CD ' ' HZ3' ' A' ' 27' ' ' LYS . 3.9 tt0 -58.67 -52.2 66.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.909 -0.587 . . . . 2.2000000000000002 111.534 -177.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -73.71 -31.29 63.32 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.413 -0.358 . . . . 1.6699999999999999 110.81 -172.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 mmmp? -60.78 -55.57 31.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.209 -0.45 . . . . 2.5299999999999998 111.578 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.403 HD13 ' N ' ' A' ' 34' ' ' SER . 4.0 pp -70.33 -26.58 63.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.73 0.3 . . . . 1.24 110.8 -179.564 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.495 ' O ' ' HA ' ' A' ' 38' ' ' LYS . 70.0 m -69.22 -34.17 74.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.765 0.316 . . . . 1.6599999999999999 110.518 175.636 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.6 m -71.68 -34.32 69.58 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.909 0.385 . . . . 0.79000000000000004 110.788 175.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.27 -54.85 7.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.012 -0.54 . . . . 1.24 111.92 -177.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.7 mt -89.25 -29.33 19.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.645 0.259 . . . . 1.49 111.066 -176.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.495 ' HA ' ' O ' ' A' ' 34' ' ' SER . 17.5 ttmt 60.99 78.78 0.3 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.737 -0.665 . . . . 3.8500000000000001 111.33 176.716 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.563 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 59.1 Cg_endo -94.76 160.94 1.81 Allowed 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 123.309 2.673 . . . . 0.67000000000000004 113.388 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 31.6 p -86.11 -39.82 16.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.665 0.745 . . . . 1.3700000000000001 109.096 174.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.531 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 89.2 t80 -124.02 128.19 48.99 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.883 -1.053 . . . . 0.83999999999999997 109.395 176.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.466 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 2.7 tm? -140.57 115.79 9.91 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.174 -0.676 . . . . 2.1899999999999999 109.174 -178.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -130.37 132.43 45.8 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.832 0.348 . . . . 2.23 111.437 -177.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.8 mp -108.52 115.7 30.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.986 -0.552 . . . . 2.23 109.855 172.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.436 ' CG2' ' HB3' ' A' ' 56' ' ' ASP . 11.0 m -106.48 149.42 9.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.344 -0.389 . . . . 1.72 110.813 177.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -64.44 120.02 11.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.602 -0.726 . . . . 1.8300000000000001 110.046 176.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.3 tttp . . . . . 0 C--N 1.318 -0.766 0 N-CA-C 108.885 -0.783 . . . . 3.2400000000000002 108.885 178.392 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.9 m . . . . . 0 N--CA 1.452 -0.327 0 N-CA-C 109.19 -0.67 . . . . 2.04 109.19 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -131.49 147.4 52.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.043 0.449 . . . . 1.3 111.74 -172.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.436 ' HB3' ' CG2' ' A' ' 45' ' ' VAL . 5.6 t70 -110.4 119.03 37.91 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.343 -0.984 . . . . 1.3500000000000001 108.343 173.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -107.03 123.02 47.59 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.117 0.484 . . . . 1.23 111.786 -175.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.8 t -94.41 111.45 25.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.678 -0.692 . . . . 1.1799999999999999 109.203 174.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.499 HG22 ' HA ' ' A' ' 94' ' ' CYS . 0.0 OUTLIER -108.97 115.66 50.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 121.562 0.696 . . . . 1.9399999999999999 110.636 -178.111 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.531 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 85.3 t -112.3 106.17 20.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.025 -0.989 . . . . 1.3700000000000001 109.029 176.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.563 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 29.8 t -145.04 154.8 42.9 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.413 0.523 . . . . 1.3100000000000001 112.413 -172.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.723 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 0.9 OUTLIER -66.87 -19.48 65.74 Favored 'General case' 0 C--O 1.221 -0.419 0 CA-C-N 115.334 -0.848 . . . . 1.6699999999999999 110.742 171.894 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -69.27 2.17 3.14 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.088 0.471 . . . . 1.8100000000000001 111.028 -178.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -124.59 4.25 8.26 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.754 0.312 . . . . 3.8700000000000001 111.126 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.723 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.2 OUTLIER -74.88 -9.6 58.7 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 121.892 -0.505 . . . . 2.1400000000000001 111.636 -176.965 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.6 p-10 -87.44 -9.98 53.17 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.968 0.414 . . . . 2.0299999999999998 109.995 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.8 ttpp 64.67 25.14 13.04 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.174 -0.921 . . . . 3.8599999999999999 111.32 173.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.486 ' HE3' HD11 ' A' ' 70' ' ' LEU . 30.4 mmmt -94.67 89.83 5.89 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.358 0.599 . . . . 2.4900000000000002 109.617 176.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.464 HD11 ' N ' ' A' ' 70' ' ' LEU . 4.0 pp -69.19 -30.31 68.47 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.763 -0.653 . . . . 2.8900000000000001 110.994 -174.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.493 HD21 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.32 -33.88 76.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.651 0.263 . . . . 1.6000000000000001 110.573 177.204 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.493 ' N ' HD21 ' A' ' 70' ' ' LEU . 25.5 t70 -74.22 -40.21 62.6 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.676 -0.49 . . . . 2.0800000000000001 109.676 178.188 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -59.11 -44.44 91.99 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.425 -0.583 . . . . 3.4199999999999999 109.425 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -57.7 -55.25 37.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.662 -0.699 . . . . 1.3700000000000001 111.255 178.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.465 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 2.3 ptm180 -61.5 -41.51 97.39 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 111.784 0.29 . . . . 2.1000000000000001 111.784 -175.558 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.5 mt -64.18 -50.88 66.39 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.883 0.373 . . . . 2.1299999999999999 110.786 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 54.1 t -56.28 -45.7 81.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.84 -0.618 . . . . 1.4099999999999999 110.92 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -64.36 -31.29 72.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.633 -0.258 . . . . 1.21 111.413 -178.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 85.2 m -66.03 -49.32 68.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.572 -0.286 . . . . 1.3200000000000001 111.408 -178.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.1 mp -79.45 -46.0 23.27 Favored 'Isoleucine or valine' 0 C--O 1.242 0.666 0 CA-C-O 121.364 0.602 . . . . 1.46 110.701 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.807 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.8 mp -73.15 -5.46 39.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.074 -0.512 . . . . 1.3799999999999999 111.711 -175.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -49.46 -63.94 0.95 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.215 -0.291 . . . . 2.4199999999999999 110.215 171.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.465 ' O ' ' HG2' ' A' ' 85' ' ' GLN . 6.0 tp10 -75.1 -37.6 61.45 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.264 0.554 . . . . 2.9100000000000001 110.507 175.85 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.807 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 3.8 tp10 -53.01 -55.15 25.78 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.412 -0.813 . . . . 1.6599999999999999 112.603 -174.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.654 ' HG ' ' HB3' ' A' ' 80' ' ' LEU . 55.3 mt -50.4 -30.53 12.62 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.846 -1.07 . . . . 1.27 113.386 -176.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 19.5 mm-40 -51.16 -27.35 8.44 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.018 0.372 . . . . 0.96999999999999997 111.67 -176.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.521 ' HB3' HD13 ' A' ' 25' ' ' ILE . 44.5 m-80 -77.74 -24.82 48.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.386 -0.37 . . . . 1.02 111.337 -178.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.416 HD11 HG23 ' A' ' 29' ' ' ILE . 1.8 mt -103.64 156.87 5.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.451 -0.574 . . . . 1.3100000000000001 109.451 -176.265 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 39.4 t60 -98.46 -36.73 9.85 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.548 -0.461 . . . . 2.29 110.173 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -147.54 96.84 2.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.118 -0.492 . . . . 1.3999999999999999 110.679 178.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -101.09 136.09 41.49 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.174 -0.466 . . . . 0.63 110.887 178.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 33.0 t -125.76 152.51 45.28 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.111 -0.7 . . . . 1.9399999999999999 109.111 177.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -143.39 134.72 26.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.306 0.574 . . . . 1.27 111.505 -177.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -117.42 109.28 16.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.646 -0.706 . . . . 2.71 109.412 174.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.499 ' HA ' HG22 ' A' ' 59' ' ' ILE . 7.5 p -92.77 130.62 38.32 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.276 0.56 . . . . 2.0 111.555 -176.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.407 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 40.3 m80 -143.88 167.08 23.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.586 -0.733 . . . . 2.6099999999999999 110.017 178.174 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 39.1 p -101.63 159.15 30.26 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 116.238 -0.437 . . . . 1.27 110.006 176.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -58.68 -29.44 89.43 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.252 1.968 . . . . 1.0900000000000001 111.166 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.85 -45.48 70.97 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.542 -0.754 . . . . 2.6200000000000001 109.781 177.129 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.477 ' HA ' ' CE ' ' A' ' 102' ' ' LYS . 8.5 tp10 -61.95 -42.55 99.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.044 0.449 . . . . 2.6899999999999999 110.284 177.656 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -64.66 -32.53 74.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.683 -0.689 . . . . 1.6100000000000001 110.429 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -59.45 -36.49 76.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.052 -0.522 . . . . 1.23 111.266 -178.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.477 ' CE ' ' HA ' ' A' ' 99' ' ' GLU . 0.0 OUTLIER -63.64 -44.66 93.19 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.962 -0.295 . . . . 3.1499999999999999 110.518 176.592 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 51.7 mt . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 116.177 -0.465 . . . . 1.5900000000000001 110.948 -176.543 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 33.7 m . . . . . 0 C--O 1.235 0.34 0 N-CA-C 110.126 -0.324 . . . . 2.2000000000000002 110.126 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.9 tp -56.1 -35.62 42.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 O-C-N 123.075 0.235 . . . . 1.8200000000000001 110.893 -178.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.47 HE21 ' HG ' ' A' ' 44' ' ' LEU . 39.0 tt0 -53.27 -49.98 65.8 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.86 0.362 . . . . 1.99 110.763 175.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.458 ' HD3' ' HA ' ' A' ' 27' ' ' LYS . 70.3 mmtt -71.32 -23.89 62.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.965 -0.562 . . . . 2.9300000000000002 112.187 -174.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 46.4 t -67.22 -52.21 45.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-O 121.163 0.506 . . . . 1.6299999999999999 109.844 176.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.418 HG13 ' OE1' ' A' ' 83' ' ' GLU . 1.8 mp -60.42 -48.56 87.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.413 -0.812 . . . . 1.3300000000000001 109.905 175.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -56.4 -49.71 73.72 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.086 -0.961 . . . . 2.2000000000000002 111.117 -178.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -56.33 -50.74 70.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.146 -0.479 . . . . 1.6699999999999999 111.767 -177.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.464 ' HZ2' ' CD ' ' A' ' 83' ' ' GLU . 5.3 mtmp? -63.28 -46.83 84.94 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.415 0.524 . . . . 2.5299999999999998 112.415 -175.523 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.438 HD12 ' N ' ' A' ' 34' ' ' SER . 4.3 pp -71.42 -28.83 64.27 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.24 -0.584 . . . . 1.24 110.848 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.438 ' N ' HD12 ' A' ' 33' ' ' LEU . 23.1 t -69.21 -36.93 77.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.931 0.396 . . . . 1.6599999999999999 110.149 177.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.1 m -71.6 -28.0 63.51 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.409 -0.359 . . . . 0.79000000000000004 111.189 178.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.09 -54.92 5.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.313 -0.403 . . . . 1.24 112.005 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.6 mp -88.86 -25.68 22.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.601 0.238 . . . . 1.49 110.639 -177.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.469 ' HB2' ' HE2' ' A' ' 38' ' ' LYS . 19.9 ttmm 59.82 78.18 0.35 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.56 -0.746 . . . . 3.8500000000000001 111.373 177.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.869 ' HA ' ' HB3' ' A' ' 61' ' ' SER . 97.4 Cg_endo -93.0 157.93 2.68 Favored 'Trans proline' 0 N--CA 1.451 -1.024 0 C-N-CA 123.177 2.585 . . . . 0.67000000000000004 113.167 -177.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.0 p -89.65 -28.05 19.74 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.813 -0.63 . . . . 1.3700000000000001 109.826 175.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.419 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 83.4 t80 -138.3 139.77 39.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.687 -0.688 . . . . 0.83999999999999997 110.13 178.233 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.616 HD21 ' HA ' ' A' ' 59' ' ' ILE . 0.2 OUTLIER -142.21 116.36 9.45 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.228 -0.656 . . . . 2.1899999999999999 109.228 179.135 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -114.54 127.78 55.98 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.947 0.403 . . . . 2.23 110.263 177.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.47 ' HG ' HE21 ' A' ' 26' ' ' GLN . 3.7 mm? -98.94 115.79 29.7 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.765 -0.652 . . . . 2.23 110.214 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.521 ' HB ' ' HB3' ' A' ' 56' ' ' ASP . 29.6 t -103.49 146.22 11.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.453 -0.794 . . . . 1.72 109.32 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -69.79 129.87 40.75 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.832 -0.433 . . . . 1.8300000000000001 109.832 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.679 ' HA ' ' HE3' ' A' ' 47' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.478 0 CA-C-O 121.047 0.451 . . . . 3.2400000000000002 110.044 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.0 p . . . . . 0 N--CA 1.454 -0.268 0 N-CA-C 110.288 -0.264 . . . . 2.04 110.288 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -128.3 152.45 48.12 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.251 0.548 . . . . 1.3 111.652 -175.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.521 ' HB3' ' HB ' ' A' ' 45' ' ' VAL . 13.7 t70 -113.67 134.2 54.87 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.232 -1.025 . . . . 1.3500000000000001 108.232 174.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -125.31 120.99 32.71 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.279 0.561 . . . . 1.23 112.378 -174.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.3 t -92.52 110.98 23.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.484 -0.78 . . . . 1.1799999999999999 108.996 171.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.907 HD12 ' HG ' ' A' ' 61' ' ' SER . 0.0 OUTLIER -105.4 120.47 56.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.252 -0.431 . . . . 1.9399999999999999 110.576 -176.899 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.474 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 58.1 t -115.79 106.92 21.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.73 -0.668 . . . . 1.3700000000000001 110.373 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.907 ' HG ' HD12 ' A' ' 59' ' ' ILE . 86.9 p -153.37 153.09 31.9 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.884 0.374 . . . . 1.3100000000000001 111.048 -179.019 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.844 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 23.9 m-80 -67.17 -19.35 65.57 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.122 -0.49 . . . . 1.6699999999999999 112.078 175.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -52.5 -25.43 10.25 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.868 -0.52 . . . . 1.8100000000000001 111.505 -177.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -100.37 -1.34 36.28 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.685 0.624 . . . . 3.8700000000000001 112.685 -174.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.844 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -72.98 -15.59 61.54 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.542 -0.724 . . . . 2.1400000000000001 111.669 -178.938 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -80.18 5.25 14.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.136 0.493 . . . . 2.0299999999999998 110.317 -178.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt 62.58 26.74 15.86 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.355 -0.839 . . . . 3.8599999999999999 110.803 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.57 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 71.0 mmtt -83.77 97.9 9.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.912 -0.586 . . . . 2.4900000000000002 111.799 -177.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -73.69 -44.11 57.45 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 115.404 -0.817 . . . . 2.8900000000000001 108.906 175.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.478 HD21 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.74 -33.17 74.34 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.012 -0.54 . . . . 1.6000000000000001 111.503 -178.042 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.57 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 30.6 t70 -66.82 -50.29 63.08 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 109.749 -0.463 . . . . 2.0800000000000001 109.749 177.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -57.42 -43.64 83.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.74 -0.664 . . . . 3.4199999999999999 109.591 176.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -61.45 -50.94 70.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.658 -0.701 . . . . 1.3700000000000001 111.708 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.07 -35.81 66.74 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.072 -0.251 . . . . 2.1000000000000001 111.319 -174.358 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.0 mp -64.3 -50.09 69.21 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.792 0.33 . . . . 2.1299999999999999 110.801 177.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.779 HG13 HD23 ' A' ' 80' ' ' LEU . 42.0 t -58.73 -47.52 88.77 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.4 0 CA-C-N 116.048 -0.524 . . . . 1.4099999999999999 110.976 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.421 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 13.2 m-80 -62.47 -38.26 89.15 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.905 -0.318 . . . . 1.21 111.702 -178.255 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 87.6 m -61.4 -57.87 10.5 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.06 0.393 . . . . 1.3200000000000001 112.06 -177.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.7 mp -81.37 -46.09 20.47 Favored 'Isoleucine or valine' 0 C--O 1.239 0.522 0 CA-C-O 121.457 0.646 . . . . 1.46 110.839 -175.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.839 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.6 mp -74.55 -5.35 42.32 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.867 -0.606 . . . . 1.3799999999999999 111.504 -175.204 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.421 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 20.5 tptm -49.73 -63.64 1.05 Allowed 'General case' 0 C--O 1.227 -0.117 0 N-CA-C 109.772 -0.455 . . . . 2.4199999999999999 109.772 169.091 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -75.2 -30.19 60.57 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.294 0.569 . . . . 2.9100000000000001 110.322 179.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.839 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 6.7 tp10 -56.8 -55.59 32.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.553 -0.748 . . . . 1.6599999999999999 112.001 -179.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.646 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 75.0 mt -50.37 -30.77 13.0 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.173 -0.921 . . . . 1.27 112.634 -178.361 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 22.2 mm-40 -52.76 -30.76 34.62 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 120.954 0.407 . . . . 0.96999999999999997 111.163 -176.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -96.57 5.36 50.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.199 -0.455 . . . . 1.02 111.395 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 9.1 mt -122.89 136.62 59.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.507 -0.315 . . . . 1.3100000000000001 110.285 -178.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -73.38 -38.68 65.58 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.939 0.399 . . . . 2.29 110.226 179.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.32 102.0 1.09 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.899 -0.592 . . . . 1.3999999999999999 110.416 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -94.64 140.22 30.16 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.388 -0.369 . . . . 0.63 110.221 177.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.8 m -128.83 140.19 51.82 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.335 -0.617 . . . . 1.9399999999999999 109.335 176.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -129.71 133.3 46.97 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.149 0.5 . . . . 1.27 110.909 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 42.1 tptt -124.34 116.36 22.47 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.996 -0.547 . . . . 2.71 109.927 174.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.499 ' HA ' HG22 ' A' ' 59' ' ' ILE . 65.9 m -89.22 134.37 34.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.835 -0.621 . . . . 2.0 111.753 -173.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.474 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 55.9 m-70 -136.84 153.48 50.77 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.187 -0.915 . . . . 2.6099999999999999 109.393 175.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.426 HG21 ' HB3' ' A' ' 65' ' ' GLU . 0.6 OUTLIER -93.54 150.71 39.31 Favored Pre-proline 0 C--N 1.314 -0.958 0 CA-C-N 116.282 -0.417 . . . . 1.27 110.173 174.579 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . 0.528 ' HG2' ' ND2' ' A' ' 62' ' ' ASN . 50.3 Cg_exo -57.09 -31.85 91.54 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.707 2.271 . . . . 1.0900000000000001 112.072 -179.244 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -67.64 -50.86 55.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.528 -0.76 . . . . 2.6200000000000001 110.229 176.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.67 -27.31 66.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.541 -0.299 . . . . 2.6899999999999999 111.636 -178.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -73.77 -32.69 63.92 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.766 -0.457 . . . . 1.6100000000000001 109.766 173.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -59.5 -42.64 92.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.809 -0.632 . . . . 1.23 109.855 177.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.8 -32.57 65.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.899 -0.591 . . . . 3.1499999999999999 110.985 177.12 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 70.2 mt . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 1.5900000000000001 112.088 -176.248 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.502 ' O ' HG23 ' A' ' 28' ' ' VAL . 48.2 t . . . . . 0 N--CA 1.453 -0.311 0 N-CA-C 107.85 -1.167 . . . . 2.2000000000000002 107.85 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 7.0 tp -59.08 -38.7 75.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.106 0.479 . . . . 1.8200000000000001 110.218 177.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -63.4 -39.27 94.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.912 -0.586 . . . . 1.99 110.165 176.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -69.66 -33.83 73.14 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.98 -0.555 . . . . 2.9300000000000002 110.782 -179.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 24' ' ' CYS . 94.8 t -57.61 -53.02 50.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 110.202 -0.296 . . . . 1.6299999999999999 110.202 176.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.9 mp -68.08 -45.35 83.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.244 -0.434 . . . . 1.3300000000000001 111.181 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -61.38 -52.27 65.31 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.648 0.261 . . . . 2.2000000000000002 110.934 -176.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -69.56 -27.17 64.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.491 -0.322 . . . . 1.6699999999999999 110.786 -176.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.424 ' HE2' ' HB3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -62.61 -55.65 25.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.189 -0.46 . . . . 2.5299999999999998 111.172 178.489 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.425 HD11 ' N ' ' A' ' 34' ' ' SER . 3.8 pp -74.26 -30.11 61.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.538 -0.301 . . . . 1.24 111.135 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.425 ' N ' HD11 ' A' ' 33' ' ' LEU . 23.1 t -63.9 -51.59 63.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.419 -0.355 . . . . 1.6599999999999999 110.837 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.0 m -71.27 -27.23 63.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.568 -0.287 . . . . 0.79000000000000004 111.284 -177.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.28 -53.89 7.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.522 -0.308 . . . . 1.24 111.678 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.4 mt -83.49 -34.97 25.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.525 -0.307 . . . . 1.49 111.344 -176.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.4 mttp 62.83 85.71 0.16 Allowed Pre-proline 0 N--CA 1.464 0.233 0 CA-C-N 115.636 -0.711 . . . . 3.8500000000000001 111.927 -177.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -94.49 157.89 1.98 Allowed 'Trans proline' 0 N--CA 1.45 -1.067 0 C-N-CA 123.164 2.576 . . . . 0.67000000000000004 112.162 175.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 21.5 p -78.81 -29.48 44.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.413 0.625 . . . . 1.3700000000000001 109.539 176.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.472 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 82.9 t80 -141.68 134.49 28.7 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.068 -0.969 . . . . 0.83999999999999997 109.841 175.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -140.63 112.72 7.75 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.024 -0.732 . . . . 2.1899999999999999 109.024 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -113.37 122.32 47.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.76 -0.459 . . . . 2.23 109.76 177.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.461 HD13 ' HB3' ' A' ' 55' ' ' PHE . 0.1 OUTLIER -97.97 115.36 28.01 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.618 -0.512 . . . . 2.23 109.618 179.727 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 39.0 t -112.93 135.34 52.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 116.594 -0.276 . . . . 1.72 110.81 -176.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -67.72 112.86 5.05 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.211 -0.663 . . . . 1.8300000000000001 109.211 171.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.416 ' HB3' ' OG ' ' A' ' 54' ' ' SER . 56.4 tttp . . . . . 0 C--N 1.319 -0.753 0 CA-C-N 115.784 -0.644 . . . . 3.2400000000000002 110.787 -173.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.416 ' OG ' ' HB3' ' A' ' 47' ' ' LYS . 32.6 t . . . . . 0 N--CA 1.447 -0.611 0 N-CA-C 109.06 -0.718 . . . . 2.04 109.06 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.461 ' HB3' HD13 ' A' ' 44' ' ' LEU . 41.9 m-85 -124.67 132.62 53.39 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.858 0.361 . . . . 1.3 111.268 -172.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -115.46 114.46 25.07 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 107.423 -1.325 . . . . 1.3500000000000001 107.423 171.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.05 117.76 34.88 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.026 0.441 . . . . 1.23 111.523 -172.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.8 t -80.4 110.78 16.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 108.985 -0.746 . . . . 1.1799999999999999 108.985 173.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -112.65 112.6 41.14 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.663 0.744 . . . . 1.9399999999999999 110.376 -176.25 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 75.3 t -110.26 108.72 26.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.082 -0.963 . . . . 1.3700000000000001 108.931 175.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.1 t -149.04 155.04 40.17 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.359 0.6 . . . . 1.3100000000000001 112.402 -172.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -66.99 -19.44 65.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 114.922 -1.035 . . . . 1.6699999999999999 111.602 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 35.0 p30 -68.33 -25.39 65.09 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.852 -0.339 . . . . 1.8100000000000001 111.244 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.48 ' HD2' HG23 ' A' ' 96' ' ' THR . 57.6 t80 -85.72 -12.78 50.28 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.454 0.645 . . . . 3.8700000000000001 109.723 176.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.47 -24.64 34.14 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.299 -0.864 . . . . 2.1400000000000001 109.027 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -67.49 -21.25 65.52 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.325 -0.852 . . . . 2.0299999999999998 109.065 173.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt 65.06 23.66 12.47 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.005 -0.998 . . . . 3.8599999999999999 110.966 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -90.74 89.82 7.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.956 -0.566 . . . . 2.4900000000000002 110.098 177.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.4 tt -61.65 -49.83 74.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.437 -0.801 . . . . 2.8900000000000001 110.733 -175.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.409 HD23 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -63.49 -31.66 72.89 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.716 0.265 . . . . 1.6000000000000001 111.716 -178.586 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.637 ' O ' ' HG2' ' A' ' 74' ' ' ARG . 12.4 m-20 -73.98 -46.23 45.13 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.113 -0.235 . . . . 2.0800000000000001 111.42 -179.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -67.3 -26.68 66.64 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.391 -0.524 . . . . 3.4199999999999999 109.92 176.479 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -70.94 -48.01 55.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.066 -0.516 . . . . 1.3700000000000001 110.473 176.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.637 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 7.7 ptm180 -63.69 -34.69 78.42 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.524 -0.307 . . . . 2.1000000000000001 110.759 -178.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 95.3 mt -68.03 -50.12 57.3 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.378 -0.374 . . . . 2.1299999999999999 110.2 177.393 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.572 HG13 HD23 ' A' ' 80' ' ' LEU . 43.5 t -57.4 -41.34 78.34 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 CA-C-N 116.019 -0.537 . . . . 1.4099999999999999 110.781 178.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -62.15 -45.74 92.06 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.775 0.321 . . . . 1.21 111.203 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 59.1 m -65.52 -45.86 81.84 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.038 0.447 . . . . 1.3200000000000001 111.361 -175.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 47.3 mt -77.46 -50.68 19.84 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 CA-C-O 121.464 0.65 . . . . 1.46 110.985 -176.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.846 ' HA ' ' CB ' ' A' ' 83' ' ' GLU . 9.7 mp -77.27 -3.97 42.53 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.636 -0.711 . . . . 1.3799999999999999 111.903 -173.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.2 tptt -52.35 -63.68 1.06 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.601 -0.518 . . . . 2.4199999999999999 109.601 172.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -75.53 -30.56 59.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.438 -0.347 . . . . 2.9100000000000001 111.243 174.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.846 ' CB ' ' HA ' ' A' ' 80' ' ' LEU . 2.6 tp10 -54.28 -54.7 36.67 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.048 0.451 . . . . 1.6599999999999999 111.585 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.73 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 66.0 mt -50.34 -30.86 13.09 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.203 -0.908 . . . . 1.27 112.317 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -54.19 -28.14 38.64 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.757 0.313 . . . . 0.96999999999999997 111.128 -177.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -90.34 -6.89 54.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.869 0.366 . . . . 1.02 111.136 -178.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.514 HG22 ' HB2' ' A' ' 90' ' ' PHE . 4.2 mt -114.9 146.49 19.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.297 -0.411 . . . . 1.3100000000000001 109.944 -175.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 60.9 t60 -95.01 -28.7 14.99 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.848 0.356 . . . . 2.29 110.079 176.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -158.68 95.58 1.32 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.18 -0.464 . . . . 1.3999999999999999 110.994 178.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . 0.514 ' HB2' HG22 ' A' ' 87' ' ' ILE . 81.9 t80 -99.39 144.5 28.43 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.222 -0.445 . . . . 0.63 110.702 176.23 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 51.1 m -142.82 147.45 35.47 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.458 -0.571 . . . . 1.9399999999999999 109.458 173.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -115.19 137.15 52.34 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.279 0.561 . . . . 1.27 111.248 -177.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.609 ' HB2' ' HZ2' ' A' ' 93' ' ' LYS . 0.1 OUTLIER -111.62 108.84 18.46 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 107.955 -1.128 . . . . 2.71 107.955 175.229 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 6.3 p -100.1 128.57 46.16 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.414 0.524 . . . . 2.0 112.414 -169.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.524 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 44.5 m80 -141.58 159.79 41.49 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-O 121.543 0.687 . . . . 2.6099999999999999 111.52 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.48 HG23 ' HD2' ' A' ' 64' ' ' PHE . 0.6 OUTLIER -103.28 149.6 37.12 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 114.932 -1.031 . . . . 1.27 110.67 177.362 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . 0.437 ' HA ' ' HB3' ' A' ' 100' ' ' TYR . 22.2 Cg_endo -61.79 -24.81 77.85 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.838 2.359 . . . . 1.0900000000000001 112.876 -178.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.403 HD21 ' HA ' ' A' ' 98' ' ' LEU . 0.3 OUTLIER -61.87 -51.41 68.33 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.803 -0.443 . . . . 2.6200000000000001 109.803 179.047 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 19.7 mp0 -72.77 -33.36 66.26 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.084 -0.507 . . . . 2.6899999999999999 111.118 177.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.437 ' HB3' ' HA ' ' A' ' 97' ' ' PRO . 50.0 t80 -58.65 -39.84 81.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.428 -0.351 . . . . 1.6100000000000001 111.241 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -57.16 -36.1 70.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.997 0.427 . . . . 1.23 110.657 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.71 ' HE2' ' N ' ' A' ' 102' ' ' LYS . 0.5 OUTLIER -70.44 -35.76 73.55 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.191 -0.459 . . . . 3.1499999999999999 110.396 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 86.3 mt . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 1.5900000000000001 111.12 -178.773 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.516 ' O ' HG23 ' A' ' 28' ' ' VAL . 53.3 t . . . . . 0 N--CA 1.456 -0.146 0 N-CA-C 110.523 -0.177 . . . . 2.2000000000000002 110.523 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.9 tp -52.54 -31.99 16.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 O-C-N 123.642 0.589 . . . . 1.8200000000000001 111.714 -177.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -60.64 -54.87 40.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.903 0.382 . . . . 1.99 110.101 176.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.1 tttp -71.98 -21.8 61.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.155 -0.475 . . . . 2.9300000000000002 111.495 -178.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.516 HG23 ' O ' ' A' ' 24' ' ' CYS . 72.9 t -59.64 -45.26 94.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 109.644 -0.502 . . . . 1.6299999999999999 109.644 174.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.12 -41.17 88.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.945 -0.571 . . . . 1.3300000000000001 110.102 175.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 68.7 mt-10 -53.76 -52.22 60.88 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.22 -0.446 . . . . 2.2000000000000002 111.037 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -75.43 -30.9 60.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.977 -0.556 . . . . 1.6699999999999999 110.919 -174.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.457 ' HZ3' ' CD ' ' A' ' 83' ' ' GLU . 55.0 tttm -60.68 -52.56 64.63 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.273 -0.421 . . . . 2.5299999999999998 110.718 -179.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -74.23 -26.03 60.01 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.847 -0.341 . . . . 1.24 110.699 178.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.4 t -67.49 -39.19 85.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.321 -0.399 . . . . 1.6599999999999999 110.413 179.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.0 m -71.33 -27.27 63.27 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.879 0.371 . . . . 0.79000000000000004 110.973 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.43 -45.22 10.72 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.188 0.44 . . . . 1.24 112.188 -175.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 86.3 mt -95.63 -21.96 17.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.676 0.274 . . . . 1.49 111.391 -176.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt 56.11 80.42 0.29 Allowed Pre-proline 0 C--N 1.329 -0.317 0 C-N-CA 123.399 0.68 . . . . 3.8500000000000001 112.116 -178.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.423 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 51.4 Cg_endo -92.92 138.98 1.64 Allowed 'Trans proline' 0 N--CA 1.446 -1.294 0 C-N-CA 122.938 2.425 . . . . 0.67000000000000004 111.684 171.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 13.5 p -75.7 -26.86 57.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.225 0.536 . . . . 1.3700000000000001 109.808 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.475 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 88.2 t80 -140.87 137.35 33.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.338 -0.846 . . . . 0.83999999999999997 109.757 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 48.4 tp -136.27 117.14 14.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.34 -0.391 . . . . 2.1899999999999999 110.338 178.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.456 ' HB2' ' CE2' ' A' ' 41' ' ' PHE . 40.5 tt0 -112.63 115.23 28.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.161 -0.472 . . . . 2.23 110.502 -178.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -94.28 117.12 29.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 2.23 110.101 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 57.2 t -120.37 127.9 75.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.113 -0.494 . . . . 1.72 111.08 -178.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -75.77 101.36 5.04 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.374 0.607 . . . . 1.8300000000000001 109.41 172.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.433 ' HE3' ' HB2' ' A' ' 47' ' ' LYS . 20.7 ttmt . . . . . 0 C--N 1.319 -0.729 0 CA-C-N 115.57 -0.741 . . . . 3.2400000000000002 110.012 -175.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.419 ' HA ' ' O ' ' A' ' 89' ' ' ALA . 26.6 p . . . . . 0 N--CA 1.45 -0.432 0 CA-C-O 120.994 0.426 . . . . 2.04 111.891 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -111.57 135.97 51.42 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.913 -0.585 . . . . 1.3 109.533 174.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -119.27 118.38 31.1 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.449 -0.575 . . . . 1.3500000000000001 109.449 179.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -109.79 122.77 48.25 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.053 0.454 . . . . 1.23 111.767 -174.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 61.3 t -91.57 111.64 24.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.746 -0.661 . . . . 1.1799999999999999 109.265 174.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.462 ' CG1' ' HA ' ' A' ' 94' ' ' CYS . 1.4 pp -99.25 138.12 24.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.388 -0.369 . . . . 1.9399999999999999 110.358 -176.394 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.475 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 66.0 t -124.76 99.76 6.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 108.999 -0.741 . . . . 1.3700000000000001 108.999 174.437 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.423 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 31.4 t -139.25 148.19 42.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.053 0.454 . . . . 1.3100000000000001 111.8 -174.559 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.431 ' ND2' ' HG2' ' A' ' 97' ' ' PRO . 0.9 OUTLIER -67.66 -19.09 65.16 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.537 -0.756 . . . . 1.6699999999999999 111.033 174.164 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -56.1 -40.0 73.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.817 0.342 . . . . 1.8100000000000001 111.908 -175.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -94.25 5.24 52.38 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.942 0.349 . . . . 3.8700000000000001 111.942 -171.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.44 -14.6 60.86 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.873 -0.517 . . . . 2.1400000000000001 110.318 -178.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.537 ' OD2' ' HG2' ' A' ' 68' ' ' LYS . 23.1 t70 -81.27 -12.54 59.06 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.673 -0.694 . . . . 2.0299999999999998 109.793 174.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt 67.79 35.96 3.72 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.195 -0.911 . . . . 3.8599999999999999 110.731 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.869 ' HB3' ' HB2' ' A' ' 71' ' ' ASP . 32.2 mmtm -72.6 95.9 1.9 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.059 -0.519 . . . . 2.4900000000000002 111.225 177.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.421 ' O ' ' HG3' ' A' ' 72' ' ' ARG . 2.8 tm? -73.71 -47.32 40.36 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.759 -0.46 . . . . 2.8900000000000001 109.759 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.45 HD21 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.28 -32.09 72.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.275 -0.421 . . . . 1.6000000000000001 111.253 -177.966 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.869 ' HB2' ' HB3' ' A' ' 68' ' ' LYS . 3.6 m-20 -73.94 -42.52 60.42 Favored 'General case' 0 CA--C 1.52 -0.209 0 C-N-CA 120.976 -0.29 . . . . 2.0800000000000001 111.285 179.034 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.46 ' C ' ' HE ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -63.91 -28.32 69.75 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 120.128 -0.629 . . . . 3.4199999999999999 109.589 178.168 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 75.9 t60 -65.36 -58.88 4.79 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.19 -0.459 . . . . 1.3700000000000001 110.064 176.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.513 ' HD3' ' OD1' ' A' ' 71' ' ' ASP . 5.6 ptm180 -63.91 -41.6 97.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.019 -0.537 . . . . 2.1000000000000001 111.616 -175.099 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 89.2 mt -66.54 -51.39 57.08 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.631 0.253 . . . . 2.1299999999999999 110.866 -177.612 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.848 HG11 HD23 ' A' ' 80' ' ' LEU . 25.3 t -58.49 -44.94 90.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.439 . . . . 1.4099999999999999 111.171 -179.211 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.488 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 13.5 m120 -63.61 -43.11 97.86 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.714 -0.394 . . . . 1.21 111.277 -177.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 35.0 m -67.85 -40.99 83.61 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.138 0.422 . . . . 1.3200000000000001 112.138 -174.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.562 HG21 ' OE2' ' A' ' 83' ' ' GLU . 17.1 mt -90.07 -52.19 10.96 Favored 'Isoleucine or valine' 0 C--O 1.25 1.106 0 CA-C-O 122.011 0.91 . . . . 1.46 110.826 -175.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.848 HD23 HG11 ' A' ' 76' ' ' VAL . 9.7 mp -67.68 -9.85 47.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.352 -0.84 . . . . 1.3799999999999999 110.477 -179.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 55.5 tptt -47.07 -56.84 5.81 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 109.592 -0.522 . . . . 2.4199999999999999 109.592 165.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.544 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 43.7 mt-10 -74.99 -30.56 61.2 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.078 -0.51 . . . . 2.9100000000000001 111.253 -179.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.591 ' HB2' ' HA ' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -52.56 -56.09 17.69 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 122.353 1.073 . . . . 1.6599999999999999 110.91 173.764 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.767 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 32.9 mt -50.5 -30.69 13.43 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 112.94 -1.936 . . . . 1.27 112.906 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.544 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 26.1 mm-40 -59.12 -23.63 62.3 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 120.55 -0.46 . . . . 0.96999999999999997 110.54 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 -102.28 -23.23 14.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.126 -0.488 . . . . 1.02 111.154 -178.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.9 mt -110.3 133.87 54.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.757 0.313 . . . . 1.3100000000000001 111.03 -174.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 39.1 t60 -72.03 -43.34 65.13 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.853 0.359 . . . . 2.29 110.201 178.108 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.419 ' O ' ' HA ' ' A' ' 54' ' ' SER . . . -145.5 105.03 3.97 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.959 0.409 . . . . 1.3999999999999999 110.862 178.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -105.37 132.83 51.06 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.0 0.429 . . . . 0.63 110.672 176.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.9 m -123.77 145.96 48.66 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.921 -0.581 . . . . 1.9399999999999999 109.445 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -132.27 138.65 47.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.299 0.571 . . . . 1.27 111.499 -176.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -109.34 109.22 20.04 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.491 -0.777 . . . . 2.71 109.282 172.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.462 ' HA ' ' CG1' ' A' ' 59' ' ' ILE . 9.0 p -83.34 99.81 10.26 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.967 -0.561 . . . . 2.0 110.336 -176.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.5 m170 -118.45 163.01 17.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.452 0.644 . . . . 2.6099999999999999 111.423 -178.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.97 156.32 50.26 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 115.275 -0.875 . . . . 1.27 110.732 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . 0.431 ' HG2' ' ND2' ' A' ' 62' ' ' ASN . 35.0 Cg_exo -58.63 -27.88 84.34 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.947 2.431 . . . . 1.0900000000000001 112.823 -177.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.51 -51.21 70.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.977 0.418 . . . . 2.6200000000000001 109.999 178.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.493 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 11.4 mp0 -65.6 -43.68 88.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.907 -0.588 . . . . 2.6899999999999999 110.666 178.164 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -59.43 -37.39 77.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.095 -0.502 . . . . 1.6100000000000001 110.938 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -57.9 -34.59 69.99 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.298 0.571 . . . . 1.23 110.503 178.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.64 ' HE2' ' N ' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -78.89 -44.97 21.59 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.5 -0.773 . . . . 3.1499999999999999 110.466 176.678 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 86.4 mt . . . . . 0 N--CA 1.464 0.259 0 CA-C-N 116.032 -0.531 . . . . 1.5900000000000001 111.894 -176.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 67.8 m . . . . . 0 C--O 1.238 0.469 0 CA-C-O 121.15 0.5 . . . . 2.2000000000000002 111.236 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 11.9 tt -67.15 -35.87 75.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.914 -0.584 . . . . 1.8200000000000001 111.325 -177.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -62.12 -36.62 82.31 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 120.743 -0.383 . . . . 1.99 110.128 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.7 tppt? -65.63 -44.66 85.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.382 -0.372 . . . . 2.9300000000000002 110.489 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.0 t -54.59 -54.31 23.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 CA-C-O 120.865 0.364 . . . . 1.6299999999999999 110.93 178.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.431 HG13 ' OE1' ' A' ' 83' ' ' GLU . 1.8 mp -61.88 -54.64 31.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.029 -0.532 . . . . 1.3300000000000001 110.992 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -55.41 -52.44 63.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.025 -0.534 . . . . 2.2000000000000002 111.801 -174.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.04 -28.54 60.46 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.675 -0.41 . . . . 1.6699999999999999 111.381 -170.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.456 ' HZ3' ' CD ' ' A' ' 83' ' ' GLU . 8.1 ttpm? -67.95 -48.13 66.74 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.615 -0.434 . . . . 2.5299999999999998 110.665 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -72.99 -29.64 63.2 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.781 -0.368 . . . . 1.24 110.944 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.0 m -70.44 -34.8 72.88 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 116.574 -0.284 . . . . 1.6599999999999999 111.058 178.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 56.4 m -71.59 -27.4 63.1 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.786 0.327 . . . . 0.79000000000000004 111.2 177.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.7 -49.68 15.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.282 -0.417 . . . . 1.24 111.739 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 91.0 mt -84.15 -31.66 25.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.859 0.361 . . . . 1.49 110.401 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.454 ' HA ' ' HD2' ' A' ' 38' ' ' LYS . 41.5 tptt 55.57 88.46 0.12 Allowed Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 114.959 -1.019 . . . . 3.8500000000000001 111.695 -176.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.929 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 97.4 Cg_endo -89.18 137.87 3.21 Favored 'Trans proline' 0 N--CA 1.451 -0.997 0 C-N-CA 122.743 2.295 . . . . 0.67000000000000004 112.606 179.188 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.4 p -69.91 -29.85 67.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.452 0.644 . . . . 1.3700000000000001 109.735 173.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.77 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 90.8 t80 -140.74 127.94 20.96 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.173 -0.921 . . . . 0.83999999999999997 109.112 175.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -136.28 126.05 25.62 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.518 -0.549 . . . . 2.1899999999999999 109.518 -178.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -129.64 127.84 41.41 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.735 -0.468 . . . . 2.23 109.735 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -94.99 115.75 27.83 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.78 -0.452 . . . . 2.23 109.78 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 60.8 t -103.44 121.76 55.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-N 116.041 -0.527 . . . . 1.72 110.395 -177.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -68.48 111.15 4.52 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.981 -0.554 . . . . 1.8300000000000001 109.667 177.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.698 ' HD3' ' HB2' ' A' ' 56' ' ' ASP . 18.5 tptt . . . . . 0 N--CA 1.447 -0.578 0 N-CA-C 108.883 -0.784 . . . . 3.2400000000000002 108.883 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.443 ' HG ' ' HB3' ' A' ' 47' ' ' LYS . 12.3 p . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 120.782 0.325 . . . . 2.04 110.963 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -127.4 133.53 49.99 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.323 -0.398 . . . . 1.3 110.818 -178.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.698 ' HB2' ' HD3' ' A' ' 47' ' ' LYS . 27.7 t0 -112.34 115.67 29.13 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.697 -0.853 . . . . 1.3500000000000001 108.697 177.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.85 119.53 39.39 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.208 0.528 . . . . 1.23 111.738 -171.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 48.4 t -84.27 111.32 19.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.646 -0.706 . . . . 1.1799999999999999 109.33 176.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.488 HG21 ' HA ' ' A' ' 94' ' ' CYS . 0.0 OUTLIER -107.52 109.29 27.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.712 0.767 . . . . 1.9399999999999999 110.45 -176.818 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.77 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 97.3 t -106.88 108.66 25.72 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 114.929 -1.032 . . . . 1.3700000000000001 109.024 175.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.929 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 31.2 t -153.38 155.08 35.74 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.064 0.459 . . . . 1.3100000000000001 111.935 -172.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.531 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 14.0 m120 -62.55 -19.44 63.67 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.409 -0.814 . . . . 1.6699999999999999 110.476 173.038 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -49.73 -46.62 50.52 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.775 -0.648 . . . . 1.8100000000000001 111.307 176.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -94.17 2.5 55.94 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.898 -0.592 . . . . 3.8700000000000001 110.812 -175.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.531 ' HB3' ' HA ' ' A' ' 62' ' ' ASN . 0.2 OUTLIER -85.25 -24.58 27.72 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-O 121.4 0.619 . . . . 2.1400000000000001 109.527 -176.51 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -77.2 1.38 18.6 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.739 -0.664 . . . . 2.0299999999999998 110.496 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 87.3 mttt 68.8 11.05 8.22 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.344 -0.844 . . . . 3.8599999999999999 112.7 175.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.6 mmmm -84.51 89.43 7.43 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.155 -0.618 . . . . 2.4900000000000002 110.229 -178.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.5 HD13 ' N ' ' A' ' 70' ' ' LEU . 3.3 pp -73.77 -34.25 64.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.033 -0.531 . . . . 2.8900000000000001 111.082 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.5 ' N ' HD13 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -68.0 -33.88 75.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.336 -0.393 . . . . 1.6000000000000001 111.036 178.387 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.659 ' O ' ' HG2' ' A' ' 74' ' ' ARG . 27.3 m-20 -74.03 -46.17 45.08 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.169 -0.213 . . . . 2.0800000000000001 111.153 -178.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.458 ' HG2' ' HA ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -61.07 -34.51 75.01 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.21 -0.596 . . . . 3.4199999999999999 109.918 176.84 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -64.44 -50.67 66.66 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.275 -0.421 . . . . 1.3700000000000001 110.163 179.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.659 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 4.4 ptm180 -66.15 -36.25 82.62 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.218 -0.446 . . . . 2.1000000000000001 110.944 -177.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 92.4 mt -66.94 -53.32 32.97 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.712 0.292 . . . . 2.1299999999999999 110.659 178.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.614 HG12 HD22 ' A' ' 80' ' ' LEU . 54.9 t -58.18 -44.18 87.19 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 CA-C-N 116.029 -0.532 . . . . 1.4099999999999999 110.895 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.54 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -62.3 -42.03 99.01 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.637 0.236 . . . . 1.21 111.637 -178.655 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 47.2 m -69.15 -48.91 61.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.923 0.392 . . . . 1.3200000000000001 111.577 -175.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 39.6 mt -75.49 -50.76 22.85 Favored 'Isoleucine or valine' 0 C--O 1.239 0.549 0 CA-C-O 121.522 0.677 . . . . 1.46 110.663 -177.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.889 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 9.6 mp -76.61 -5.36 47.42 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-N 115.631 -0.713 . . . . 1.3799999999999999 111.377 -175.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.54 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 18.7 tppt? -52.39 -63.63 1.08 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.559 -0.534 . . . . 2.4199999999999999 109.559 172.296 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -75.36 -30.71 60.29 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.758 -0.655 . . . . 2.9100000000000001 110.963 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.889 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 5.0 tp10 -55.96 -54.36 45.68 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.003 0.43 . . . . 1.6599999999999999 111.539 178.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.762 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 68.7 mt -50.69 -30.42 13.69 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-N 115.388 -0.824 . . . . 1.27 112.494 -178.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 -54.54 -28.29 44.51 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.629 0.252 . . . . 0.96999999999999997 111.362 -176.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -92.35 0.81 57.47 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.031 0.443 . . . . 1.02 110.951 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.503 HG22 ' HB2' ' A' ' 90' ' ' PHE . 9.5 mt -121.73 143.21 35.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.121 -0.491 . . . . 1.3100000000000001 109.847 -177.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 37.3 t60 -77.85 -46.06 22.51 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.699 -0.482 . . . . 2.29 109.699 176.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -153.77 102.74 2.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.07 -0.514 . . . . 1.3999999999999999 110.982 178.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . 0.503 ' HB2' HG22 ' A' ' 87' ' ' ILE . 83.2 t80 -102.33 131.84 48.69 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.278 -0.419 . . . . 0.63 110.24 175.523 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 31.6 t -122.37 157.53 31.62 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.502 -0.555 . . . . 1.9399999999999999 109.502 178.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -144.43 139.96 28.69 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.078 0.466 . . . . 1.27 110.958 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 26.5 mmtp -121.22 109.13 14.59 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.66 -0.7 . . . . 2.71 109.143 177.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.488 ' HA ' HG21 ' A' ' 59' ' ' ILE . 7.4 p -98.79 131.04 45.22 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.167 0.508 . . . . 2.0 112.23 -172.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.413 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 1.5 m170 -148.75 175.52 11.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.599 -0.728 . . . . 2.6099999999999999 110.223 174.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.401 ' HB ' ' HD2' ' A' ' 97' ' ' PRO . 74.9 p -103.25 159.24 29.9 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.293 -0.412 . . . . 1.27 111.229 -175.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . 0.401 ' HD2' ' HB ' ' A' ' 96' ' ' THR . 20.4 Cg_endo -61.81 -26.41 79.44 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.634 2.222 . . . . 1.0900000000000001 111.667 176.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.65 -48.94 75.19 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.417 -0.586 . . . . 2.6200000000000001 109.417 178.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.545 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 11.4 mm-40 -61.24 -49.61 76.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.671 -0.695 . . . . 2.6899999999999999 110.597 177.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -59.57 -42.88 93.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.856 -0.611 . . . . 1.6100000000000001 110.882 -178.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -61.48 -37.69 84.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 1.23 110.842 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.796 ' HA ' ' HE3' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -65.18 -38.35 90.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.412 -0.358 . . . . 3.1499999999999999 110.998 177.247 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 54.3 mt . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 116.041 -0.527 . . . . 1.5900000000000001 110.67 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.459 ' O ' HG21 ' A' ' 28' ' ' VAL . 41.1 t . . . . . 0 N--CA 1.452 -0.328 0 N-CA-C 110.032 -0.359 . . . . 2.2000000000000002 110.032 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 10.3 tp -54.08 -31.15 21.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.045 -0.525 . . . . 1.8200000000000001 111.244 -178.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -59.38 -52.35 65.99 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.033 -0.53 . . . . 1.99 110.449 177.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -71.92 -29.64 64.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.818 -0.628 . . . . 2.9300000000000002 111.116 -177.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.459 HG21 ' O ' ' A' ' 24' ' ' CYS . 87.1 t -56.94 -50.21 76.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.838 0.351 . . . . 1.6299999999999999 110.392 177.397 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.68 HG23 ' HG3' ' A' ' 83' ' ' GLU . 1.7 mp -66.68 -39.85 84.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.972 -0.558 . . . . 1.3300000000000001 110.546 177.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -59.14 -52.19 66.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.95 -0.568 . . . . 2.2000000000000002 110.89 -177.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -67.24 -36.55 81.88 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.108 0.48 . . . . 1.6699999999999999 110.494 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 53.4 tttm -64.46 -52.57 57.32 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.592 -0.731 . . . . 2.5299999999999998 111.592 -176.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.428 HD11 ' N ' ' A' ' 34' ' ' SER . 4.6 pp -71.51 -28.45 63.91 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.753 -0.379 . . . . 1.24 110.549 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.428 ' N ' HD11 ' A' ' 33' ' ' LEU . 39.4 t -63.74 -45.2 90.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.094 0.473 . . . . 1.6599999999999999 110.024 177.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.0 m -62.16 -27.41 68.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.789 -0.641 . . . . 0.79000000000000004 111.926 -178.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -93.35 -54.67 3.59 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.031 0.382 . . . . 1.24 112.031 -177.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 96.5 mt -72.47 -30.83 64.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.373 -0.376 . . . . 1.49 111.335 -175.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm 61.12 68.07 1.31 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.871 -0.604 . . . . 3.8500000000000001 111.45 -178.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.517 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 72.6 Cg_endo -90.32 126.92 1.36 Allowed 'Trans proline' 0 N--CA 1.447 -1.245 0 C-N-CA 122.549 2.166 . . . . 0.67000000000000004 111.824 173.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.9 p -64.53 -26.36 68.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.301 0.572 . . . . 1.3700000000000001 110.191 177.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.53 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 77.9 t80 -141.78 140.22 32.98 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.373 -0.83 . . . . 0.83999999999999997 109.319 173.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -142.15 108.76 5.35 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.898 -0.778 . . . . 2.1899999999999999 108.898 179.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.521 ' HB3' ' HB ' ' A' ' 58' ' ' VAL . 27.1 tt0 -100.14 140.36 34.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.402 -0.363 . . . . 2.23 110.104 -178.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -107.45 120.39 42.05 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.09 0.472 . . . . 2.23 110.862 -179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 40.8 t -109.85 125.56 67.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 108.864 -0.791 . . . . 1.72 108.864 172.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -69.92 113.52 7.22 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.002 0.429 . . . . 1.8300000000000001 109.908 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.427 ' O ' ' HB2' ' A' ' 54' ' ' SER . 0.7 OUTLIER . . . . . 0 C--N 1.32 -0.677 0 CA-C-N 116.109 -0.496 . . . . 3.2400000000000002 110.394 -176.368 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' ' 47' ' ' LYS . 14.6 m . . . . . 0 N--CA 1.447 -0.592 0 N-CA-C 109.808 -0.441 . . . . 2.04 109.808 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -135.14 141.37 45.95 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.654 -0.248 . . . . 1.3 110.502 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.68 108.44 17.49 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.455 -0.943 . . . . 1.3500000000000001 108.455 174.492 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.78 118.54 36.84 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.996 0.427 . . . . 1.23 111.525 -173.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.521 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 32.2 t -83.59 112.5 21.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.538 -0.541 . . . . 1.1799999999999999 109.538 177.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.49 HG12 ' HA ' ' A' ' 94' ' ' CYS . 2.8 pt -96.87 145.29 9.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.178 0.513 . . . . 1.9399999999999999 110.675 -177.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.53 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 60.8 t -137.86 97.56 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 N-CA-C 108.028 -1.101 . . . . 1.3700000000000001 108.028 174.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.517 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 40.8 t -144.61 150.66 37.81 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.04 0.756 . . . . 1.3100000000000001 113.04 -170.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.67 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 1.0 OUTLIER -67.22 -19.19 65.5 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 114.818 -1.083 . . . . 1.6699999999999999 110.886 172.939 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -55.55 -32.93 63.38 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.291 0.478 . . . . 1.8100000000000001 112.291 -172.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -104.35 -3.07 24.62 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.191 0.441 . . . . 3.8700000000000001 112.191 -173.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.67 ' HG2' ' O ' ' A' ' 62' ' ' ASN . 9.6 pt-20 -76.73 0.4 20.61 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.906 -0.496 . . . . 2.1400000000000001 111.15 -177.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.449 ' OD2' ' HG3' ' A' ' 68' ' ' LYS . 26.6 t70 -88.98 -8.71 53.59 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.064 0.459 . . . . 2.0299999999999998 110.061 177.146 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt 77.32 -13.82 0.91 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 115.244 -0.889 . . . . 3.8599999999999999 112.887 174.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.449 ' HG3' ' OD2' ' A' ' 66' ' ' ASP . 29.9 mtmm -72.28 111.85 7.85 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.961 0.41 . . . . 2.4900000000000002 110.971 176.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.4 pp -73.87 -31.41 63.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.796 -0.638 . . . . 2.8900000000000001 111.738 -176.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.424 ' C ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -65.9 -31.1 71.85 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.677 -0.409 . . . . 1.6000000000000001 111.335 -175.002 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.525 ' O ' ' HG2' ' A' ' 74' ' ' ARG . 1.5 t70 -73.88 -37.13 64.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.248 0.547 . . . . 2.0800000000000001 109.969 -178.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.3 tmm_? -63.66 -44.14 94.66 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.967 -0.753 . . . . 3.4199999999999999 108.967 174.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 21.1 t60 -61.48 -50.25 73.51 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.243 -0.889 . . . . 1.3700000000000001 111.272 -178.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.525 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 9.3 ptm180 -62.0 -38.6 89.26 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.5 -0.318 . . . . 2.1000000000000001 111.192 -177.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -67.4 -54.18 22.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.973 0.416 . . . . 2.1299999999999999 110.633 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.841 HG12 HD22 ' A' ' 80' ' ' LEU . 65.2 t -58.86 -48.67 85.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.062 -0.517 . . . . 1.4099999999999999 111.237 -177.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.476 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -59.37 -48.23 82.42 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 121.161 -0.216 . . . . 1.21 111.464 -177.176 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 58.7 m -62.45 -54.77 35.23 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.813 0.671 . . . . 1.3200000000000001 112.813 -173.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.628 HG22 ' OE2' ' A' ' 83' ' ' GLU . 5.1 mp -85.08 -48.38 16.44 Favored 'Isoleucine or valine' 0 C--O 1.247 0.947 0 CA-C-O 121.545 0.688 . . . . 1.46 111.103 -174.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.841 HD22 HG12 ' A' ' 76' ' ' VAL . 8.1 mp -68.51 -10.32 54.85 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.972 -0.558 . . . . 1.3799999999999999 110.752 -177.151 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.476 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 20.7 tptm -52.01 -58.44 6.52 Favored 'General case' 0 C--N 1.333 -0.112 0 N-CA-C 109.493 -0.558 . . . . 2.4199999999999999 109.493 165.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.533 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 39.5 mt-10 -60.8 -36.43 79.02 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.331 -0.85 . . . . 2.9100000000000001 110.72 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.68 ' HG3' HG23 ' A' ' 29' ' ' ILE . 0.0 OUTLIER -52.76 -55.6 21.69 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 122.178 0.99 . . . . 1.6599999999999999 110.381 173.254 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.749 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 54.6 mt -50.25 -30.6 12.09 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 113.061 -1.881 . . . . 1.27 112.691 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.533 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 20.7 mm-40 -61.64 -25.6 67.47 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 120.909 0.385 . . . . 0.96999999999999997 110.736 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -98.35 -29.85 12.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.003 -0.544 . . . . 1.02 111.133 -176.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.477 HD11 ' HB2' ' A' ' 90' ' ' PHE . 2.7 mt -94.95 170.86 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 109.649 -0.5 . . . . 1.3100000000000001 109.649 -178.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -94.63 -59.34 1.95 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.199 -0.667 . . . . 2.29 109.199 169.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -133.71 111.27 10.43 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.765 -0.652 . . . . 1.3999999999999999 110.312 178.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . 0.477 ' HB2' HD11 ' A' ' 87' ' ' ILE . 90.2 t80 -95.21 122.51 37.97 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.112 0.482 . . . . 0.63 110.278 177.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 41.6 t -111.07 151.71 27.75 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.721 -0.672 . . . . 1.9399999999999999 109.381 178.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -140.27 145.29 37.11 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.913 0.387 . . . . 1.27 110.849 -177.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.471 ' HG3' HG21 ' A' ' 58' ' ' VAL . 61.9 mmtt -105.89 113.87 27.68 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.325 -0.991 . . . . 2.71 108.325 173.223 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.49 ' HA ' HG12 ' A' ' 59' ' ' ILE . 5.5 p -83.39 110.35 18.08 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.093 0.473 . . . . 2.0 111.087 -176.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -135.86 160.29 39.04 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.433 0.635 . . . . 2.6099999999999999 111.254 178.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.4 p -120.23 156.45 54.99 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.398 -0.819 . . . . 1.27 110.724 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -56.52 -52.12 7.71 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 123.259 2.639 . . . . 1.0900000000000001 114.393 -170.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -61.19 -47.37 86.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.79 0.328 . . . . 2.6200000000000001 111.398 -173.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 53.6 mp0 -68.14 -42.67 79.76 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.163 -0.471 . . . . 2.6899999999999999 111.105 -178.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -63.95 -33.42 75.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 1.6100000000000001 111.498 -176.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -62.8 -33.14 74.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.96 0.41 . . . . 1.23 111.147 -178.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.67 ' HE2' ' N ' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -75.17 -20.63 59.24 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.438 -0.346 . . . . 3.1499999999999999 110.684 179.478 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 83.5 mt . . . . . 0 C--N 1.326 -0.443 0 N-CA-C 109.84 -0.43 . . . . 1.5900000000000001 109.84 175.819 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.438 ' O ' HG23 ' A' ' 28' ' ' VAL . 43.0 t . . . . . 0 N--CA 1.451 -0.414 0 N-CA-C 108.916 -0.772 . . . . 2.2000000000000002 108.916 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 7.2 tp -55.85 -43.93 76.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 120.624 0.249 . . . . 1.8200000000000001 110.872 178.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -66.06 -35.68 81.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.97 0.414 . . . . 1.99 110.412 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -61.8 -39.32 91.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.819 -0.628 . . . . 2.9300000000000002 110.432 179.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 24' ' ' CYS . 65.3 t -60.82 -49.5 84.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.91 -0.586 . . . . 1.6299999999999999 110.254 178.164 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.438 HG13 ' CD ' ' A' ' 83' ' ' GLU . 1.7 mp -57.4 -49.75 79.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 116.089 -0.505 . . . . 1.3300000000000001 110.62 178.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 81.9 mt-10 -58.77 -51.97 67.69 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.231 -0.441 . . . . 2.2000000000000002 112.099 -176.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -70.16 -34.1 72.58 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.804 0.335 . . . . 1.6699999999999999 110.815 -174.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.405 ' HD2' ' OE2' ' A' ' 83' ' ' GLU . 37.6 ttmt -61.82 -48.86 78.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.269 -0.423 . . . . 2.5299999999999998 110.934 -178.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.6 pp -73.51 -26.22 60.79 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.887 -0.325 . . . . 1.24 110.629 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.404 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 67.0 m -72.37 -34.56 68.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.508 -0.314 . . . . 1.6599999999999999 110.628 178.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.2 m -67.16 -27.43 67.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.15 0.5 . . . . 0.79000000000000004 111.021 176.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.34 -54.82 3.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.095 -0.502 . . . . 1.24 111.843 -176.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.405 HD12 HG23 ' A' ' 76' ' ' VAL . 80.1 mt -84.06 -29.71 26.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.469 -0.332 . . . . 1.49 111.023 -175.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.3 tptm 55.84 78.38 0.38 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 115.454 -0.794 . . . . 3.8500000000000001 111.216 -176.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.594 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 83.6 Cg_endo -87.97 173.56 4.95 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 122.67 2.247 . . . . 0.67000000000000004 112.45 178.349 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.9 p -106.66 -27.61 10.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.141 0.496 . . . . 1.3700000000000001 110.287 175.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.493 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 86.2 t80 -136.63 138.57 41.3 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.825 -0.625 . . . . 0.83999999999999997 109.886 177.067 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 41.5 tp -142.21 116.45 9.5 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.255 -0.43 . . . . 2.1899999999999999 110.418 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -125.58 109.53 12.76 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.4 -0.364 . . . . 2.23 110.674 178.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.592 ' HG ' ' HB2' ' A' ' 57' ' ' ALA . 9.1 mp -94.87 123.58 38.42 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.394 -0.595 . . . . 2.23 109.394 173.056 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 86.1 t -103.33 133.2 47.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 115.974 -0.557 . . . . 1.72 110.489 -176.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -64.11 110.08 2.05 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.711 -0.677 . . . . 1.8300000000000001 109.595 174.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.914 ' HD2' ' HB2' ' A' ' 56' ' ' ASP . 79.3 tttt . . . . . 0 C--N 1.322 -0.611 0 CA-C-N 115.105 -0.952 . . . . 3.2400000000000002 109.706 -173.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.483 ' HB3' ' HB3' ' A' ' 89' ' ' ALA . 1.7 p . . . . . 0 N--CA 1.454 -0.237 0 CA-C-O 120.478 0.18 . . . . 2.04 110.696 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -134.53 144.38 47.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.939 0.399 . . . . 1.3 111.372 -177.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.914 ' HB2' ' HD2' ' A' ' 47' ' ' LYS . 5.5 t70 -115.88 114.15 24.3 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.386 -0.968 . . . . 1.3500000000000001 108.386 174.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.592 ' HB2' ' HG ' ' A' ' 44' ' ' LEU . . . -110.63 126.54 54.59 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.436 0.532 . . . . 1.23 112.436 -171.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.4 t -93.08 119.84 41.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.601 -0.727 . . . . 1.1799999999999999 109.67 175.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.423 HD11 ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER -109.87 122.24 64.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 121.244 0.545 . . . . 1.9399999999999999 110.471 -178.56 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.493 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 89.8 t -114.45 107.82 23.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.596 -0.729 . . . . 1.3700000000000001 109.92 178.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.594 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 30.5 t -151.02 154.93 37.98 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.948 0.404 . . . . 1.3100000000000001 111.693 -174.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.482 ' ND2' ' HG2' ' A' ' 97' ' ' PRO . 1.0 OUTLIER -67.25 -18.86 65.4 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.744 -0.662 . . . . 1.6699999999999999 110.569 173.992 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -53.31 -24.19 11.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.258 -0.428 . . . . 1.8100000000000001 111.892 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -103.23 -8.31 20.49 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 111.994 0.368 . . . . 3.8700000000000001 111.994 -177.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -14.31 61.44 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.96 -0.463 . . . . 2.1400000000000001 110.988 -174.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -78.36 0.57 25.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.104 -0.498 . . . . 2.0299999999999998 110.545 -176.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 84.9 tttt 71.73 2.09 4.15 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.705 -0.679 . . . . 3.8599999999999999 111.174 176.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -80.28 89.62 5.51 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.046 0.45 . . . . 2.4900000000000002 110.272 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.8 tt -70.91 -49.03 50.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.857 -0.611 . . . . 2.8900000000000001 109.732 -179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.506 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -60.85 -33.25 72.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.85 -0.613 . . . . 1.6000000000000001 111.628 -179.557 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.506 ' N ' HD22 ' A' ' 70' ' ' LEU . 35.8 t70 -74.07 -48.06 32.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.931 0.396 . . . . 2.0800000000000001 110.293 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.15 -36.28 74.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.243 0.544 . . . . 3.4199999999999999 109.636 176.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 48.8 t60 -64.21 -54.8 27.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.505 -0.77 . . . . 1.3700000000000001 110.774 178.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.441 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 15.5 ptm180 -64.98 -40.39 94.91 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.004 0.372 . . . . 2.1000000000000001 112.004 -175.433 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 60.2 mt -60.22 -53.34 58.91 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.922 0.392 . . . . 2.1299999999999999 110.787 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.429 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 78.6 t -61.17 -43.59 96.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.922 -0.581 . . . . 1.4099999999999999 110.626 179.589 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.483 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -64.17 -35.88 82.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.279 -0.418 . . . . 1.21 112.078 -177.365 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 88.6 m -71.92 -44.39 63.72 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.775 0.322 . . . . 1.3200000000000001 111.335 -176.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.1 mt -76.84 -50.86 20.21 Favored 'Isoleucine or valine' 0 C--O 1.244 0.811 0 CA-C-O 121.769 0.795 . . . . 1.46 110.612 -178.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.76 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 10.5 mp -74.14 -9.29 58.47 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.356 -0.838 . . . . 1.3799999999999999 111.418 -176.38 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 16.2 tttm -53.88 -61.93 1.98 Allowed 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 109.778 -0.453 . . . . 2.4199999999999999 109.778 172.071 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.429 ' CD ' ' HZ1' ' A' ' 81' ' ' LYS . 0.4 OUTLIER -72.18 -30.07 64.61 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.689 -0.687 . . . . 2.9100000000000001 110.288 -178.074 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.662 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.5 tp10 -55.88 -47.52 77.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.334 -0.848 . . . . 1.6599999999999999 111.588 175.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.76 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 54.4 mt -49.96 -30.87 11.23 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 114.8 -1.091 . . . . 1.27 113.58 -178.259 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -55.54 -18.06 6.63 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.562 0.578 . . . . 0.96999999999999997 112.562 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -87.08 -8.19 57.31 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.749 0.309 . . . . 1.02 111.228 179.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.45 HD12 ' HB2' ' A' ' 90' ' ' PHE . 0.4 OUTLIER -133.27 175.87 10.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.885 -0.413 . . . . 1.3100000000000001 109.885 -177.588 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 14.4 p80 -116.28 -13.99 11.07 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.622 -0.431 . . . . 2.29 110.969 173.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.483 ' HB3' ' HB3' ' A' ' 54' ' ' SER . . . -162.15 105.94 1.18 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.919 0.39 . . . . 1.3999999999999999 111.418 -178.447 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . 0.45 ' HB2' HD12 ' A' ' 87' ' ' ILE . 91.2 t80 -132.17 122.04 24.66 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.919 -0.582 . . . . 0.63 110.046 175.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.4 p -116.54 144.8 43.9 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.712 0.291 . . . . 1.9399999999999999 110.721 179.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -123.38 145.95 48.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.945 0.402 . . . . 1.27 111.102 -178.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 26.4 mmtp -125.66 120.23 30.17 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.877 -0.786 . . . . 2.71 108.877 177.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.405 ' HA ' HG21 ' A' ' 59' ' ' ILE . 5.9 p -101.25 135.47 42.67 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.487 0.551 . . . . 2.0 112.487 -172.32 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 8.5 m80 -147.74 172.61 13.82 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.536 -0.756 . . . . 2.6099999999999999 109.473 174.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.449 ' HG1' ' CD ' ' A' ' 99' ' ' GLU . 0.3 OUTLIER -111.04 158.67 35.19 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-O 121.014 0.435 . . . . 1.27 111.843 -177.925 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . 0.482 ' HG2' ' ND2' ' A' ' 62' ' ' ASN . 26.1 Cg_exo -62.25 -18.36 61.99 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.201 2.601 . . . . 1.0900000000000001 112.353 -177.549 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -59.63 -51.23 70.69 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.895 -0.593 . . . . 2.6200000000000001 109.989 174.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.449 ' CD ' ' HG1' ' A' ' 96' ' ' THR . 1.9 mp0 -60.97 -44.81 96.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.109 0.481 . . . . 2.6899999999999999 110.153 175.106 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.41 ' HB3' ' HA ' ' A' ' 97' ' ' PRO . 74.1 t80 -57.6 -41.24 80.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.367 -0.833 . . . . 1.6100000000000001 111.486 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -58.87 -39.47 81.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.421 -0.354 . . . . 1.23 111.646 -178.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.693 ' HE2' ' N ' ' A' ' 102' ' ' LYS . 0.8 OUTLIER -65.4 -37.68 87.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.817 0.341 . . . . 3.1499999999999999 110.222 179.363 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 69.8 mt . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 115.703 -0.68 . . . . 1.5900000000000001 111.114 -179.025 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 51.8 t . . . . . 0 N--CA 1.452 -0.355 0 N-CA-C 109.512 -0.551 . . . . 2.2000000000000002 109.512 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.496 HD13 ' HB3' ' A' ' 86' ' ' ASN . 9.6 tp -61.41 -32.88 54.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.832 0.349 . . . . 1.8200000000000001 110.899 -179.097 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -63.67 -38.9 92.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.266 -0.425 . . . . 1.99 110.186 178.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -67.16 -34.11 76.86 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.981 -0.554 . . . . 2.9300000000000002 110.694 177.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 71.3 t -59.0 -55.35 24.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.716 0.293 . . . . 1.6299999999999999 110.619 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.476 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 2.0 mp -63.91 -44.63 98.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.982 -0.554 . . . . 1.3300000000000001 110.455 178.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 34' ' ' SER . 21.0 tt0 -52.4 -51.12 60.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.849 -0.614 . . . . 2.2000000000000002 110.904 179.332 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -71.81 -38.07 70.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.446 -0.797 . . . . 1.6699999999999999 111.344 -173.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -60.19 -55.96 27.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.322 -0.399 . . . . 2.5299999999999998 111.583 -176.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 3.7 pp -74.1 -25.32 59.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.671 -0.241 . . . . 1.24 111.508 -178.799 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.447 ' N ' HD12 ' A' ' 33' ' ' LEU . 8.0 t -68.65 -36.76 79.0 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 121.044 -0.262 . . . . 1.6599999999999999 110.652 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.1 m -70.43 -27.49 64.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.762 0.315 . . . . 0.79000000000000004 110.946 178.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.427 ' CB ' HG12 ' A' ' 79' ' ' ILE . . . -85.25 -54.88 4.33 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.067 0.395 . . . . 1.24 112.067 -176.061 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.5 mt -85.09 -34.84 22.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.647 0.26 . . . . 1.49 110.839 -176.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.5 ttmt 58.92 84.78 0.2 Allowed Pre-proline 0 C--O 1.234 0.26 0 CA-C-N 115.391 -0.822 . . . . 3.8500000000000001 111.727 178.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.845 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 93.8 Cg_endo -93.77 161.27 2.28 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 123.073 2.516 . . . . 0.67000000000000004 112.72 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 32.7 p -89.4 -21.1 23.22 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.695 0.76 . . . . 1.3700000000000001 109.177 173.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.611 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 89.9 t80 -141.39 132.07 25.63 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.053 -0.976 . . . . 0.83999999999999997 109.47 175.079 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.5 tp -140.67 127.69 20.74 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.268 -0.423 . . . . 2.1899999999999999 110.249 -179.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -139.14 124.11 18.82 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.959 0.409 . . . . 2.23 110.609 177.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.8 mp -95.84 117.27 30.25 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.934 -0.575 . . . . 2.23 109.509 175.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 31.6 t -103.12 130.64 52.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.684 -0.689 . . . . 1.72 110.262 -176.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -79.34 101.42 8.08 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.819 -0.437 . . . . 1.8300000000000001 109.819 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm . . . . . 0 C--N 1.325 -0.471 0 CA-C-O 121.316 0.579 . . . . 3.2400000000000002 110.354 -175.053 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 N--CA 1.455 -0.208 0 N-CA-C 109.834 -0.432 . . . . 2.04 109.834 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -121.64 161.56 22.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.995 0.426 . . . . 1.3 111.312 -174.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.419 ' HA ' ' O ' ' A' ' 91' ' ' SER . 12.7 t70 -118.15 127.23 53.57 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.252 -1.018 . . . . 1.3500000000000001 108.252 171.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.91 115.8 30.85 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.138 0.494 . . . . 1.23 111.602 -174.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.3 t -81.76 111.15 17.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.652 -0.704 . . . . 1.1799999999999999 109.194 174.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.449 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -106.56 114.34 45.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.188 0.518 . . . . 1.9399999999999999 110.049 -178.494 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.611 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 97.1 t -110.02 103.86 16.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.814 -0.63 . . . . 1.3700000000000001 109.976 178.054 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.845 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 46.2 t -154.55 149.38 26.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.152 0.501 . . . . 1.3100000000000001 111.171 -177.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.551 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 40.8 m-80 -67.3 -18.64 65.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.451 -0.795 . . . . 1.6699999999999999 111.176 176.035 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -47.97 -24.45 1.06 Allowed 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 112.369 0.507 . . . . 1.8100000000000001 112.369 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.5 ' HD1' ' HB2' ' A' ' 68' ' ' LYS . 76.9 m-85 -118.6 16.05 13.68 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 112.196 0.443 . . . . 3.8700000000000001 112.196 -178.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.551 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 1.0 OUTLIER -68.82 -15.85 63.62 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 120.795 0.331 . . . . 2.1400000000000001 111.734 -176.153 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.577 ' HB3' ' HD3' ' A' ' 68' ' ' LYS . 31.0 t70 -84.37 15.6 3.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.252 0.548 . . . . 2.0299999999999998 110.118 179.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.6 ' HZ1' ' HB2' ' A' ' 67' ' ' LYS . 10.6 mtmp? 57.62 51.02 10.03 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.616 -0.72 . . . . 3.8599999999999999 109.845 -175.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.869 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 31.2 mmmt -76.91 89.03 3.48 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.871 -0.604 . . . . 2.4900000000000002 110.436 -176.149 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.7 tt -73.66 -55.01 6.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.294 0.568 . . . . 2.8900000000000001 109.681 177.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.486 HD21 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.5 -31.43 71.56 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.418 -0.81 . . . . 1.6000000000000001 110.796 -178.341 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.869 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 25.5 t70 -73.68 -35.71 65.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.901 0.382 . . . . 2.0800000000000001 110.306 -178.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -39.4 93.55 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.317 -0.623 . . . . 3.4199999999999999 109.317 174.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 39.6 t60 -65.51 -51.35 60.6 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.895 -0.593 . . . . 1.3700000000000001 110.64 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.53 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 3.8 ptm180 -66.54 -48.19 70.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.311 -0.404 . . . . 2.1000000000000001 111.81 -176.121 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -61.39 -45.03 96.06 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.57 0.224 . . . . 2.1299999999999999 111.446 -177.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.736 HG12 HD22 ' A' ' 80' ' ' LEU . 41.9 t -59.99 -42.57 90.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.427 -0.351 . . . . 1.4099999999999999 110.732 178.18 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.62 -43.6 89.06 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.947 -0.301 . . . . 1.21 111.181 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 45.1 m -61.82 -55.92 24.93 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.988 0.366 . . . . 1.3200000000000001 111.988 -177.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.427 HG12 ' CB ' ' A' ' 36' ' ' ALA . 4.2 mp -78.5 -48.6 22.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 120.819 0.342 . . . . 1.46 111.416 -176.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.752 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.7 mp -73.48 -6.68 47.92 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 116.509 -0.314 . . . . 1.3799999999999999 111.741 -173.616 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -49.75 -54.59 18.09 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.335 -0.617 . . . . 2.4199999999999999 109.335 167.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.423 ' O ' ' HG2' ' A' ' 85' ' ' GLN . 36.6 tt0 -75.19 -40.27 59.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.467 -0.788 . . . . 2.9100000000000001 110.713 178.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.752 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.8 tp10 -53.71 -51.34 63.58 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.456 -0.793 . . . . 1.6599999999999999 112.025 -177.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.675 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 67.3 mt -50.31 -30.71 12.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.204 -0.907 . . . . 1.27 112.614 -177.089 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 17.6 mm-40 -52.24 -26.53 12.03 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 111.886 0.328 . . . . 0.96999999999999997 111.886 -176.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.496 ' HB3' HD13 ' A' ' 25' ' ' ILE . 29.8 m-80 -100.23 1.49 41.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.872 0.367 . . . . 1.02 111.209 -177.231 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.432 HD13 ' HG3' ' A' ' 83' ' ' GLU . 0.5 OUTLIER -130.56 175.9 9.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 110.007 -0.368 . . . . 1.3100000000000001 110.007 -175.552 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 56.1 m-70 -123.16 -73.85 0.63 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.314 0.578 . . . . 2.29 110.008 176.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -104.91 57.72 0.69 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.406 -0.816 . . . . 1.3999999999999999 110.505 -175.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -75.19 145.27 42.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.984 -0.553 . . . . 0.63 110.887 -177.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.419 ' O ' ' HA ' ' A' ' 56' ' ' ASP . 40.1 t -140.32 167.62 21.72 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.927 -0.579 . . . . 1.9399999999999999 109.513 178.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -148.58 149.88 32.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.713 0.292 . . . . 1.27 110.707 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -125.03 109.85 13.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.183 -0.462 . . . . 2.71 110.044 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.417 ' HA ' HG22 ' A' ' 59' ' ' ILE . 4.1 p -83.41 126.91 33.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.23 0.538 . . . . 2.0 111.713 -176.287 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.448 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 45.9 m80 -142.07 162.94 34.22 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.556 -0.747 . . . . 2.6099999999999999 110.038 178.274 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.5 p -112.56 154.61 44.6 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 116.524 -0.307 . . . . 1.27 110.963 176.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . 0.49 ' HG2' ' ND2' ' A' ' 62' ' ' ASN . 35.8 Cg_exo -59.1 -26.69 82.62 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 123.031 2.487 . . . . 1.0900000000000001 112.522 -178.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -61.2 -46.43 90.48 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.872 -0.604 . . . . 2.6200000000000001 110.173 177.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -71.57 -41.07 69.49 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.802 -0.635 . . . . 2.6899999999999999 110.706 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -56.73 -40.94 76.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.906 -0.588 . . . . 1.6100000000000001 111.614 -178.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -58.1 -35.89 72.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.85 0.357 . . . . 1.23 111.043 -178.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.691 ' HE2' ' N ' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -74.18 -32.58 63.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.802 0.334 . . . . 3.1499999999999999 110.288 179.04 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 85.8 mt . . . . . 0 C--N 1.325 -0.467 0 CA-C-N 116.323 -0.399 . . . . 1.5900000000000001 110.54 179.173 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.4 t . . . . . 0 C--O 1.235 0.293 0 N-CA-C 109.47 -0.567 . . . . 2.2000000000000002 109.47 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.49 HD13 ' HB3' ' A' ' 86' ' ' ASN . 8.6 tp -56.87 -35.82 47.92 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-O 120.886 0.374 . . . . 1.8200000000000001 110.291 176.409 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -58.4 -45.98 87.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.832 -0.622 . . . . 1.99 110.527 176.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.814 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -57.66 -42.85 84.33 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.85 -0.614 . . . . 2.9300000000000002 110.627 -178.869 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.517 ' O ' ' HG2' ' A' ' 32' ' ' LYS . 60.4 t -58.82 -49.98 81.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-N 116.023 -0.535 . . . . 1.6299999999999999 110.711 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.524 HD11 ' HB2' ' A' ' 86' ' ' ASN . 1.7 mp -58.8 -46.01 91.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.895 -0.593 . . . . 1.3300000000000001 110.243 178.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 62.2 mt-10 -53.33 -50.42 65.03 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.106 -0.497 . . . . 2.2000000000000002 111.037 177.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -60.03 -33.88 72.62 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.227 -0.442 . . . . 1.6699999999999999 111.853 -176.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.517 ' HG2' ' O ' ' A' ' 28' ' ' VAL . 14.8 mmmm -71.27 -55.65 7.63 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.858 -0.337 . . . . 2.5299999999999998 111.091 -178.105 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.489 HD11 ' N ' ' A' ' 34' ' ' SER . 4.1 pp -69.43 -28.55 66.23 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.9 0.333 . . . . 1.24 111.9 -176.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.489 ' N ' HD11 ' A' ' 33' ' ' LEU . 52.5 p -72.1 -33.29 67.74 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.876 -0.33 . . . . 1.6599999999999999 110.884 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 52.3 m -68.14 -34.84 77.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.916 0.388 . . . . 0.79000000000000004 110.755 178.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.28 -54.56 4.24 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.243 0.46 . . . . 1.24 112.243 -175.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.3 mt -81.6 -23.85 36.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.396 -0.365 . . . . 1.49 110.805 -175.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 64.3 mttp 49.28 69.19 2.84 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 115.579 -0.737 . . . . 3.8500000000000001 112.193 -179.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.592 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 71.5 Cg_endo -80.85 134.53 9.62 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.039 1.826 . . . . 0.67000000000000004 112.034 176.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 20.8 p -67.02 -30.72 70.88 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.091 0.472 . . . . 1.3700000000000001 110.045 177.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.579 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 81.3 t80 -140.43 139.16 35.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.811 -0.632 . . . . 0.83999999999999997 109.851 176.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 60.9 tp -135.1 121.69 20.69 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.339 -0.391 . . . . 2.1899999999999999 110.131 178.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -119.49 115.74 24.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.982 0.42 . . . . 2.23 110.517 179.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -91.26 115.64 28.19 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.06 -0.518 . . . . 2.23 109.735 178.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 40.4 t -114.41 142.44 27.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.498 0.666 . . . . 1.72 110.676 -178.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.56 123.92 23.53 Favored 'General case' 0 N--CA 1.438 -1.041 0 CA-C-N 114.957 -1.019 . . . . 1.8300000000000001 108.836 178.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 45.4 tttp . . . . . 0 C--N 1.325 -0.488 0 CA-C-N 115.929 -0.578 . . . . 3.2400000000000002 111.335 -169.346 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.495 ' HB3' ' HB2' ' A' ' 89' ' ' ALA . 4.2 p . . . . . 0 N--CA 1.446 -0.653 0 CA-C-O 120.95 0.405 . . . . 2.04 110.571 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -113.12 132.53 55.41 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.115 -0.493 . . . . 1.3 110.03 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -114.82 109.5 18.26 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.342 -0.984 . . . . 1.3500000000000001 108.342 175.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.99 120.06 40.79 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.256 0.55 . . . . 1.23 111.832 -170.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 59.0 t -79.26 114.21 19.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 115.35 -0.841 . . . . 1.1799999999999999 109.016 173.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.472 ' CG1' ' HA ' ' A' ' 94' ' ' CYS . 1.2 pp -96.73 136.19 28.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.719 -0.475 . . . . 1.9399999999999999 109.719 -177.498 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.579 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 90.0 t -130.81 97.9 3.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 108.772 -0.825 . . . . 1.3700000000000001 108.772 176.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.592 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 40.8 t -145.39 150.92 37.43 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.291 0.567 . . . . 1.3100000000000001 111.977 -173.151 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.685 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 15.7 m120 -67.96 -19.15 64.93 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.354 -0.839 . . . . 1.6699999999999999 110.178 172.029 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -62.57 -9.07 7.6 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.013 0.435 . . . . 1.8100000000000001 111.325 -178.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -116.34 -11.83 11.18 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.125 0.417 . . . . 3.8700000000000001 112.125 -177.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.685 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -74.01 -13.73 60.91 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.382 0.512 . . . . 2.1400000000000001 112.382 -171.473 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.422 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . 7.7 t70 -91.55 10.95 25.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.006 0.431 . . . . 2.0299999999999998 110.059 178.268 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.492 ' HE3' ' HB2' ' A' ' 67' ' ' LYS . 24.9 ttmt 65.97 39.05 4.66 Favored 'General case' 0 C--N 1.338 0.105 0 CA-C-N 115.627 -0.715 . . . . 3.8599999999999999 109.392 176.473 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.633 ' HB3' ' HB2' ' A' ' 71' ' ' ASP . 64.4 mmtt -78.93 101.29 7.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.2 -0.909 . . . . 2.4900000000000002 112.469 -173.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 28.9 tp -73.81 -59.74 2.58 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.026 -0.534 . . . . 2.8900000000000001 110.146 171.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.421 HD23 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.82 -34.12 76.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.756 -0.657 . . . . 1.6000000000000001 111.821 -170.895 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.633 ' HB2' ' HB3' ' A' ' 68' ' ' LYS . 27.1 m-20 -73.86 -43.55 58.27 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.699 0.259 . . . . 2.0800000000000001 111.699 -176.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 34.9 ptt180 -64.6 -35.37 80.78 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.079 -0.648 . . . . 3.4199999999999999 109.586 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -65.13 -52.99 51.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.874 -0.603 . . . . 1.3700000000000001 110.498 179.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.497 ' CD ' ' HA ' ' A' ' 71' ' ' ASP . 5.8 ptm180 -64.6 -43.46 93.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.254 -0.43 . . . . 2.1000000000000001 111.296 -175.392 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.4 mp -65.56 -48.47 72.3 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.552 0.215 . . . . 2.1299999999999999 110.961 -178.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.746 HG11 HD23 ' A' ' 80' ' ' LEU . 38.2 t -59.86 -43.88 93.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.554 -0.294 . . . . 1.4099999999999999 110.866 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -62.76 -46.83 86.22 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.868 -0.333 . . . . 1.21 111.04 -178.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 63.0 m -61.42 -55.94 25.77 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.17 0.433 . . . . 1.3200000000000001 112.17 -177.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.0 mp -75.29 -50.25 24.94 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 120.968 0.413 . . . . 1.46 111.208 -175.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.945 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.5 mp -71.74 -5.5 34.47 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 116.371 -0.377 . . . . 1.3799999999999999 111.279 -177.072 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -49.92 -63.97 0.95 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.065 0.46 . . . . 2.4199999999999999 109.834 170.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.405 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 5.4 pt-20 -75.39 -31.43 60.45 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.156 -0.474 . . . . 2.9100000000000001 110.929 177.309 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.945 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 34.0 tt0 -58.48 -43.96 89.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.543 -0.299 . . . . 1.6599999999999999 111.127 -177.222 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.746 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 69.3 mt -57.54 -30.6 65.33 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.127 -0.488 . . . . 1.27 111.671 179.435 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.405 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 24.4 mm-40 -59.54 -17.93 36.39 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.848 0.356 . . . . 0.96999999999999997 111.121 -177.202 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.524 ' HB2' HD11 ' A' ' 29' ' ' ILE . 23.4 m-80 -102.44 3.05 37.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.428 -0.351 . . . . 1.02 110.957 -177.007 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.487 HG23 ' HB2' ' A' ' 90' ' ' PHE . 8.9 mt -124.12 147.67 28.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.645 0.259 . . . . 1.3100000000000001 110.564 -175.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 59.0 t60 -78.97 -45.18 20.88 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.811 -0.44 . . . . 2.29 109.811 175.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.495 ' HB2' ' HB3' ' A' ' 54' ' ' SER . . . -158.92 106.16 1.81 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 1.3999999999999999 110.504 178.446 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . 0.487 ' HB2' HG23 ' A' ' 87' ' ' ILE . 76.2 t80 -103.35 138.02 40.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.259 -0.428 . . . . 0.63 110.357 177.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 50.7 m -140.26 145.14 36.94 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.668 -0.493 . . . . 1.9399999999999999 109.668 175.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -123.35 151.79 42.16 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.168 0.508 . . . . 1.27 111.637 -175.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.0 mmtm -117.38 118.28 31.8 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.437 -0.801 . . . . 2.71 108.957 173.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.472 ' HA ' ' CG1' ' A' ' 59' ' ' ILE . 80.8 m -83.78 117.23 23.13 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.137 0.494 . . . . 2.0 111.605 -171.143 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 70.2 m80 -140.33 161.22 38.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.958 -0.565 . . . . 2.6099999999999999 110.332 176.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.639 ' HB ' ' HD2' ' A' ' 97' ' ' PRO . 31.0 p -110.63 168.25 7.88 Favored Pre-proline 0 C--N 1.32 -0.676 0 N-CA-C 109.209 -0.664 . . . . 1.27 109.209 174.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . 0.639 ' HD2' ' HB ' ' A' ' 96' ' ' THR . 12.1 Cg_endo -58.29 -28.53 84.88 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.092 1.861 . . . . 1.0900000000000001 111.456 174.128 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -72.92 -51.44 18.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 2.6200000000000001 109.883 178.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.567 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 1.5 mp0 -58.54 -50.99 71.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.008 -0.542 . . . . 2.6899999999999999 111.133 179.357 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -65.21 -43.39 91.71 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.742 0.275 . . . . 1.6100000000000001 111.742 -175.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -62.99 -33.31 75.14 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.988 0.423 . . . . 1.23 110.769 -177.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.598 ' HE2' ' N ' ' A' ' 102' ' ' LYS . 0.3 OUTLIER -78.41 -15.53 58.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.486 -0.325 . . . . 3.1499999999999999 111.173 179.024 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 93.6 mt . . . . . 0 N--CA 1.464 0.226 0 CA-C-O 121.087 0.47 . . . . 1.5900000000000001 109.947 175.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.8 m . . . . . 0 N--CA 1.447 -0.585 0 N-CA-C 110.004 -0.369 . . . . 2.2000000000000002 110.004 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.482 ' O ' HD12 ' A' ' 29' ' ' ILE . 0.0 OUTLIER -57.18 -35.51 48.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.233 -0.439 . . . . 1.8200000000000001 110.049 179.672 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.818 HE22 ' HG ' ' A' ' 44' ' ' LEU . 53.6 tp60 -57.35 -53.78 54.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.9 -0.591 . . . . 1.99 110.924 177.341 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.9 tptp -63.88 -40.78 97.32 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.894 -0.594 . . . . 2.9300000000000002 111.04 -173.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 66.6 t -60.55 -46.94 94.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.208 -0.451 . . . . 1.6299999999999999 111.041 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.525 ' HA ' ' OE2' ' A' ' 83' ' ' GLU . 1.5 mp -58.84 -47.08 90.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.932 -0.576 . . . . 1.3300000000000001 110.398 179.036 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.526 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 74.8 mt-10 -56.03 -52.0 65.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 2.2000000000000002 111.003 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -63.34 -36.82 84.96 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.833 0.679 . . . . 1.6699999999999999 112.833 -172.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -72.57 -47.87 44.58 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.53 -0.468 . . . . 2.5299999999999998 111.61 -177.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.473 HD13 ' N ' ' A' ' 34' ' ' SER . 4.6 pp -74.26 -31.41 62.55 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 120.581 -0.448 . . . . 1.24 111.722 -179.197 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.473 ' N ' HD13 ' A' ' 33' ' ' LEU . 66.4 m -68.69 -33.58 74.21 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 121.151 -0.22 . . . . 1.6599999999999999 111.4 -178.195 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.5 m -67.85 -27.33 66.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.95 0.405 . . . . 0.79000000000000004 110.812 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.95 -52.74 4.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 1.24 111.767 -177.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 73.2 mt -85.0 -33.06 22.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.532 -0.304 . . . . 1.49 111.738 -173.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm 55.48 75.2 0.62 Allowed Pre-proline 0 N--CA 1.466 0.364 0 CA-C-N 116.045 -0.525 . . . . 3.8500000000000001 112.173 -178.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.49 ' HB3' HG12 ' A' ' 59' ' ' ILE . 72.4 Cg_endo -82.7 133.77 7.13 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.408 2.072 . . . . 0.67000000000000004 111.989 175.498 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 37.7 p -73.09 -30.53 63.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.578 0.704 . . . . 1.3700000000000001 109.753 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -141.88 132.55 25.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.111 -0.95 . . . . 0.83999999999999997 109.328 176.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.1 tt -142.24 118.95 11.08 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.196 -0.668 . . . . 2.1899999999999999 109.196 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -116.96 120.51 38.63 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.89 0.376 . . . . 2.23 110.348 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.818 ' HG ' HE22 ' A' ' 26' ' ' GLN . 4.3 mm? -87.86 121.24 30.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.853 -0.612 . . . . 2.23 110.212 178.154 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 40.9 t -109.35 122.11 63.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.215 -0.448 . . . . 1.72 110.339 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -67.92 102.52 1.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.4 -0.593 . . . . 1.8300000000000001 109.4 176.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.506 ' HD2' ' HB2' ' A' ' 56' ' ' ASP . 51.8 tttm . . . . . 0 C--N 1.321 -0.643 0 N-CA-C 109.362 -0.606 . . . . 3.2400000000000002 109.362 -178.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.9 m . . . . . 0 N--CA 1.455 -0.183 0 CA-C-O 120.834 0.35 . . . . 2.04 110.987 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -125.28 136.17 53.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.945 -0.57 . . . . 1.3 109.6 173.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.506 ' HB2' ' HD2' ' A' ' 47' ' ' LYS . 19.3 t70 -113.24 122.39 47.31 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.89 -0.411 . . . . 1.3500000000000001 109.89 -177.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -118.77 122.27 42.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.773 0.321 . . . . 1.23 111.606 -175.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 58.3 t -86.86 111.23 21.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 109.552 -0.536 . . . . 1.1799999999999999 109.552 176.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.49 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -110.01 116.31 51.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.485 0.659 . . . . 1.9399999999999999 110.627 -176.521 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.648 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 41.8 t -108.09 114.06 45.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.356 -0.838 . . . . 1.3700000000000001 109.382 176.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.427 ' HB3' ' HA ' ' A' ' 39' ' ' PRO . 87.5 p -145.66 146.38 31.28 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.245 -0.582 . . . . 1.3100000000000001 112.256 -177.188 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -67.22 -22.8 65.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.462 -0.79 . . . . 1.6699999999999999 110.755 172.251 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -62.59 -32.11 73.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.094 -0.503 . . . . 1.8100000000000001 112.282 -172.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 31.6 m-85 -98.41 0.51 45.48 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.959 -0.297 . . . . 3.8700000000000001 111.256 -178.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.08 -18.97 62.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.556 -0.293 . . . . 2.1400000000000001 111.742 -173.644 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -84.46 -9.66 58.18 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.918 0.389 . . . . 2.0299999999999998 110.862 -175.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt 69.12 19.57 7.94 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.884 0.698 . . . . 3.8599999999999999 112.884 169.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.656 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 29.0 mmmt -75.07 110.76 9.65 Favored 'General case' 0 C--N 1.327 -0.41 0 O-C-N 121.771 -0.581 . . . . 2.4900000000000002 109.627 178.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.492 ' HA ' ' NE ' ' A' ' 72' ' ' ARG . 3.4 pp -66.53 -48.11 70.76 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.319 0.489 . . . . 2.8900000000000001 112.319 -167.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.419 HD21 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.82 -30.93 70.46 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.877 0.37 . . . . 1.6000000000000001 110.767 -178.204 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.419 ' N ' HD21 ' A' ' 70' ' ' LEU . 20.4 t70 -73.32 -47.54 41.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.003 -0.544 . . . . 2.0800000000000001 110.341 -175.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.656 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 10.9 ptt85 -66.68 -33.93 76.75 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.409 -0.36 . . . . 3.4199999999999999 110.806 177.044 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -66.82 -50.29 63.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.48 -0.327 . . . . 1.3700000000000001 110.739 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -65.67 -37.33 86.19 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.61 -0.268 . . . . 2.1000000000000001 110.995 -176.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 66.9 mt -64.13 -57.85 8.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.843 0.354 . . . . 2.1299999999999999 110.886 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.738 HG11 HD12 ' A' ' 80' ' ' LEU . 64.4 t -57.41 -49.99 78.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.053 -0.521 . . . . 1.4099999999999999 111.541 -176.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.449 ' N ' HD21 ' A' ' 77' ' ' ASN . 0.9 OUTLIER -65.69 -42.89 90.68 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.959 -0.296 . . . . 1.21 111.57 -174.447 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 85.2 m -63.24 -53.98 44.47 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.852 0.316 . . . . 1.3200000000000001 111.852 -176.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.4 mp -76.95 -51.1 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.81 0.338 . . . . 1.46 111.196 -177.109 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.855 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 15.4 mt -72.06 -15.16 62.02 Favored 'General case' 0 C--O 1.214 -0.8 0 N-CA-C 113.068 0.766 . . . . 1.3799999999999999 113.068 -171.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 31.3 tttm -65.82 -56.11 13.61 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 119.163 0.892 . . . . 2.4199999999999999 109.892 175.556 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -58.37 -32.58 68.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.323 -0.853 . . . . 2.9100000000000001 109.499 176.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.664 ' HG2' HD22 ' A' ' 80' ' ' LEU . 6.0 tp10 -60.48 -53.74 53.88 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 114.912 -1.04 . . . . 1.6599999999999999 111.11 176.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.855 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 45.4 mt -50.33 -30.65 12.56 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 114.276 -1.329 . . . . 1.27 112.059 178.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 -51.79 -24.83 6.52 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 111.721 0.267 . . . . 0.96999999999999997 111.721 -177.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.515 ' HB2' HD11 ' A' ' 29' ' ' ILE . 32.5 m-80 -94.07 -6.77 44.36 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.839 0.352 . . . . 1.02 111.417 -178.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 2.7 mt -120.26 151.18 22.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 109.891 -0.411 . . . . 1.3100000000000001 109.891 -174.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -75.48 -45.81 36.18 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.267 -0.573 . . . . 2.29 109.721 175.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.67 117.26 3.99 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.024 -0.534 . . . . 1.3999999999999999 110.18 177.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -116.02 122.35 44.95 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.108 -0.496 . . . . 0.63 110.669 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.7 p -115.33 129.5 56.62 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.322 -0.399 . . . . 1.9399999999999999 110.253 176.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -107.33 139.49 41.72 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.162 0.506 . . . . 1.27 110.591 -178.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -108.14 111.03 22.84 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.088 -0.708 . . . . 2.71 109.088 176.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 45.8 t -83.23 116.14 22.26 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.339 -0.391 . . . . 2.0 110.354 -174.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.648 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 59.2 t60 -130.12 138.98 50.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.478 0.656 . . . . 2.6099999999999999 110.35 -178.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -98.2 146.36 31.4 Favored Pre-proline 0 C--N 1.318 -0.803 0 CA-C-N 115.561 -0.745 . . . . 1.27 111.383 -179.364 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -67.14 -21.84 48.05 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.962 2.441 . . . . 1.0900000000000001 112.808 -178.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -64.14 -51.29 64.59 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.045 -0.724 . . . . 2.6200000000000001 109.045 177.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -70.76 -29.58 65.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.997 -0.547 . . . . 2.6899999999999999 110.653 178.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -62.27 -41.05 98.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.197 -0.456 . . . . 1.6100000000000001 110.662 178.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -60.97 -33.66 73.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 1.23 110.943 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.704 ' HE2' ' N ' ' A' ' 102' ' ' LYS . 0.5 OUTLIER -71.6 -24.95 61.98 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.32 -0.4 . . . . 3.1499999999999999 110.952 -179.552 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 86.1 mt . . . . . 0 C--N 1.327 -0.371 0 CA-C-N 116.36 -0.382 . . . . 1.5900000000000001 110.25 178.605 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 43.4 t . . . . . 0 C--O 1.234 0.262 0 CA-C-O 120.603 0.239 . . . . 2.2000000000000002 110.725 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.4 tp -52.5 -39.45 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 115.669 -0.696 . . . . 1.8200000000000001 111.75 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -64.83 -39.32 93.38 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.199 0.523 . . . . 1.99 110.914 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -70.34 -40.02 74.36 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.513 -0.767 . . . . 2.9300000000000002 110.658 -177.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.3 t -66.21 -46.38 87.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.899 -0.591 . . . . 1.6299999999999999 111.082 -178.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.575 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.5 mp -59.49 -49.3 84.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 1.3300000000000001 111.44 -178.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -61.17 -39.14 89.01 Favored 'General case' 0 C--O 1.226 -0.177 0 N-CA-C 110.244 -0.28 . . . . 2.2000000000000002 110.244 -177.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -64.2 -44.24 92.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.528 -0.305 . . . . 1.6699999999999999 111.079 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -70.53 -55.48 8.79 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 112.343 0.498 . . . . 2.5299999999999998 112.343 -173.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 3.3 pp -68.69 -29.3 67.72 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.433 -0.507 . . . . 1.24 111.498 -175.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.525 ' N ' HD12 ' A' ' 33' ' ' LEU . 55.0 m -73.4 -35.67 65.91 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.794 -0.362 . . . . 1.6599999999999999 111.349 177.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.9 m -67.0 -27.46 67.44 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.851 -0.34 . . . . 0.79000000000000004 111.092 176.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -92.38 -54.9 3.61 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 112.431 0.53 . . . . 1.24 112.431 -176.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.7 mt -79.46 -26.6 41.68 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.832 0.349 . . . . 1.49 110.673 -177.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 65.1 mttm 59.3 72.92 0.74 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.278 -0.874 . . . . 3.8500000000000001 112.671 176.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.516 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 84.6 Cg_endo -91.29 165.71 3.62 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 122.876 2.384 . . . . 0.67000000000000004 111.635 172.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 28.6 p -94.22 -32.27 13.75 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.038 0.446 . . . . 1.3700000000000001 110.258 178.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.692 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 82.8 t80 -133.05 134.37 44.28 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.776 -0.647 . . . . 0.83999999999999997 109.867 178.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -142.29 113.31 7.53 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.563 -0.532 . . . . 2.1899999999999999 109.563 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -111.56 134.69 52.96 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.953 -0.388 . . . . 2.23 109.953 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -110.92 124.9 53.02 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.782 0.325 . . . . 2.23 110.944 -178.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 48.3 t -127.84 133.9 66.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.056 -0.52 . . . . 1.72 109.692 175.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.405 ' HA ' ' O ' ' A' ' 54' ' ' SER . 5.6 t70 -75.03 134.0 41.51 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 120.91 0.386 . . . . 1.8300000000000001 110.164 175.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.9 tttt . . . . . 0 C--N 1.317 -0.827 0 CA-C-N 116.084 -0.507 . . . . 3.2400000000000002 110.323 -178.125 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.405 ' O ' ' HA ' ' A' ' 46' ' ' ASP . 21.7 p . . . . . 0 N--CA 1.45 -0.438 0 N-CA-C 110.471 -0.196 . . . . 2.04 110.471 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -118.8 132.43 56.13 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 121.014 -0.274 . . . . 1.3 110.86 -178.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -113.0 113.02 24.89 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 107.754 -1.202 . . . . 1.3500000000000001 107.754 171.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.0 117.88 35.17 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.172 0.511 . . . . 1.23 112.251 -169.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 61.1 t -83.64 112.28 20.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.675 -0.693 . . . . 1.1799999999999999 109.641 175.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.642 HG13 ' HA ' ' A' ' 94' ' ' CYS . 1.0 OUTLIER -100.53 140.02 20.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.254 -0.43 . . . . 1.9399999999999999 110.502 -176.051 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.692 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 95.1 t -127.98 107.44 16.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 108.864 -0.791 . . . . 1.3700000000000001 108.864 171.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.516 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 43.5 t -155.78 154.87 32.07 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.073 0.463 . . . . 1.3100000000000001 112.028 -174.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.469 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 0.8 OUTLIER -67.07 -19.47 65.67 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 115.558 -0.747 . . . . 1.6699999999999999 110.333 173.98 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -58.02 -30.47 66.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.608 -0.724 . . . . 1.8100000000000001 111.031 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -94.73 -11.1 29.73 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.185 0.517 . . . . 3.8700000000000001 110.665 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.469 ' HB3' ' HA ' ' A' ' 62' ' ' ASN . 0.6 OUTLIER -91.42 -16.13 27.83 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 108.643 -0.873 . . . . 2.1400000000000001 108.643 -176.962 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -74.22 0.64 13.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.374 -0.83 . . . . 2.0299999999999998 109.843 175.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 53.3 mmtt 64.98 37.81 6.67 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 114.837 -1.074 . . . . 3.8599999999999999 110.864 175.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.858 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 42.3 mmtm -96.1 92.07 6.25 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.063 -0.517 . . . . 2.4900000000000002 111.148 177.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.8 tt -73.64 -57.29 4.09 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.436 -0.579 . . . . 2.8900000000000001 109.436 177.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.427 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -68.18 -32.26 72.37 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.043 -0.526 . . . . 1.6000000000000001 111.448 -177.388 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.858 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 24.3 t70 -74.09 -38.65 63.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.363 -0.38 . . . . 2.0800000000000001 111.431 -173.164 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 50.9 ptt85 -62.63 -34.54 77.26 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.422 -0.511 . . . . 3.4199999999999999 109.851 177.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 73.4 t60 -69.05 -46.6 67.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.271 -0.422 . . . . 1.3700000000000001 110.53 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.523 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 3.7 ptm180 -68.17 -38.77 82.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.659 -0.246 . . . . 2.1000000000000001 110.884 -178.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -65.67 -47.58 75.03 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.833 -0.167 . . . . 2.1299999999999999 111.028 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.511 HG12 HD22 ' A' ' 80' ' ' LEU . 37.2 t -57.51 -45.4 85.94 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 CA-C-N 116.567 -0.288 . . . . 1.4099999999999999 110.665 177.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.534 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -67.35 -29.5 69.07 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.93 -0.308 . . . . 1.21 111.622 -179.031 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 91.5 m -66.25 -48.3 70.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.794 0.33 . . . . 1.3200000000000001 111.019 -178.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 21.0 mt -81.8 -51.14 15.54 Favored 'Isoleucine or valine' 0 C--O 1.242 0.671 0 CA-C-O 121.952 0.882 . . . . 1.46 110.62 -177.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.928 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.3 mp -74.67 -0.13 16.97 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.195 -0.912 . . . . 1.3799999999999999 111.27 -176.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.534 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 56.0 tptt -50.86 -63.71 1.04 Allowed 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 108.949 -0.76 . . . . 2.4199999999999999 108.949 169.523 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -75.49 -35.68 60.76 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.906 -0.588 . . . . 2.9100000000000001 110.968 176.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.928 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 30.7 tt0 -59.5 -41.18 89.29 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 111.868 0.321 . . . . 1.6599999999999999 111.868 -175.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 41.0 mt -56.46 -30.68 63.2 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.185 0.439 . . . . 1.27 112.185 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -57.83 -18.23 20.97 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.72 0.295 . . . . 0.96999999999999997 111.566 -174.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -100.27 -4.34 29.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.717 -0.22 . . . . 1.02 111.515 -177.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 6.1 mt -115.38 152.12 17.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 109.923 -0.399 . . . . 1.3100000000000001 109.923 -177.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -84.43 -38.24 20.44 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.825 -0.435 . . . . 2.29 109.825 176.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -161.08 108.41 1.49 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.213 -0.449 . . . . 1.3999999999999999 111.029 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -105.64 138.29 42.08 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.012 0.434 . . . . 0.63 110.869 176.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 44.5 m -134.61 158.84 43.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.872 -0.604 . . . . 1.9399999999999999 109.485 175.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -137.0 147.56 46.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.22 0.533 . . . . 1.27 111.755 -176.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 48.7 mmtm -119.3 109.33 15.68 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.44 -0.8 . . . . 2.71 108.978 173.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.642 ' HA ' HG13 ' A' ' 59' ' ' ILE . 4.5 p -84.01 121.29 27.2 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.059 0.457 . . . . 2.0 111.315 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -131.79 153.88 49.67 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.333 0.587 . . . . 2.6099999999999999 111.224 176.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 17.8 p -97.37 148.55 34.58 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.572 -0.74 . . . . 1.27 110.55 177.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -62.16 -30.25 81.86 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.621 2.214 . . . . 1.0900000000000001 111.979 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.52 -51.34 60.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.667 -0.697 . . . . 2.6200000000000001 109.965 -179.138 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.423 ' HA ' ' HE3' ' A' ' 102' ' ' LYS . 12.6 tp10 -72.57 -30.98 64.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.856 0.36 . . . . 2.6899999999999999 110.489 -178.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -56.09 -35.21 66.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.864 -0.607 . . . . 1.6100000000000001 111.595 -179.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -62.7 -36.57 83.37 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 121.094 -0.242 . . . . 1.23 111.031 -176.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.423 ' HE3' ' HA ' ' A' ' 99' ' ' GLU . 0.0 OUTLIER -66.62 -33.14 74.99 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.117 0.484 . . . . 3.1499999999999999 110.495 178.16 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 69.1 mt . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 115.903 -0.589 . . . . 1.5900000000000001 110.251 179.555 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 79.5 m . . . . . 0 N--CA 1.451 -0.404 0 N-CA-C 109.606 -0.516 . . . . 2.2000000000000002 109.606 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.8 tp -54.8 -31.93 25.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 O-C-N 123.386 0.429 . . . . 1.8200000000000001 111.414 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -58.6 -49.15 78.52 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.586 -0.279 . . . . 1.99 110.98 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.586 ' HE3' ' OE2' ' A' ' 30' ' ' GLU . 10.2 mmmm -70.91 -27.35 63.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.475 -0.33 . . . . 2.9300000000000002 111.372 -177.025 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 81.8 t -58.82 -54.12 38.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.902 0.382 . . . . 1.6299999999999999 110.067 176.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.486 HG12 HD12 ' A' ' 87' ' ' ILE . 1.8 mp -64.95 -48.78 82.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.615 -0.721 . . . . 1.3300000000000001 110.509 178.336 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.586 ' OE2' ' HE3' ' A' ' 27' ' ' LYS . 27.1 tt0 -58.16 -52.21 66.5 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.966 -0.561 . . . . 2.2000000000000002 111.461 -175.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.447 ' HB2' ' O ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -68.13 -31.98 71.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.542 -0.299 . . . . 1.6699999999999999 111.299 -176.059 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -66.19 -55.66 15.18 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 120.588 0.233 . . . . 2.5299999999999998 110.995 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 4.0 pp -72.8 -23.84 60.84 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.793 -0.363 . . . . 1.24 111.467 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.561 ' O ' ' HA ' ' A' ' 38' ' ' LYS . 22.7 t -69.08 -36.35 77.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.1 0.476 . . . . 1.6599999999999999 110.131 176.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.3 m -71.68 -48.92 44.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.221 -0.445 . . . . 0.79000000000000004 110.812 177.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.61 -54.76 6.84 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.614 0.598 . . . . 1.24 112.614 -173.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.8 mt -80.69 -33.41 35.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.937 0.398 . . . . 1.49 110.272 -177.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.561 ' HA ' ' O ' ' A' ' 34' ' ' SER . 18.7 ttmm 58.01 81.22 0.26 Allowed Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.045 -0.98 . . . . 3.8500000000000001 112.154 174.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.759 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 5.4 Cg_endo -87.08 147.85 7.94 Favored 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 123.165 2.577 . . . . 0.67000000000000004 112.197 178.321 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.22 -22.58 33.09 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.456 0.646 . . . . 1.3700000000000001 109.794 176.122 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.664 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 64.4 t80 -141.63 127.6 19.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.235 -0.893 . . . . 0.83999999999999997 109.156 171.164 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 48.6 tp -142.32 133.8 26.56 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.396 -0.366 . . . . 2.1899999999999999 110.273 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -149.6 139.8 22.19 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.858 0.361 . . . . 2.23 110.536 174.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.417 ' N ' HD21 ' A' ' 44' ' ' LEU . 3.1 mm? -88.61 124.68 34.29 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.499 -0.556 . . . . 2.23 109.499 176.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 59.1 t -103.17 135.35 41.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.703 -0.48 . . . . 1.72 109.703 -178.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -69.41 105.01 2.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.905 -1.043 . . . . 1.8300000000000001 111.082 -172.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.587 ' HE2' ' HB2' ' A' ' 56' ' ' ASP . 16.0 tppt? . . . . . 0 C--N 1.323 -0.554 0 CA-C-O 121.402 0.62 . . . . 3.2400000000000002 109.705 179.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.5 m . . . . . 0 N--CA 1.448 -0.526 0 N-CA-C 109.968 -0.382 . . . . 2.04 109.968 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -136.39 143.36 43.95 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.592 -0.276 . . . . 1.3 110.481 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.587 ' HB2' ' HE2' ' A' ' 47' ' ' LYS . 38.7 t70 -122.0 115.27 22.22 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.016 -0.735 . . . . 1.3500000000000001 109.016 175.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.03 119.42 39.14 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.026 0.441 . . . . 1.23 111.648 -171.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.491 ' HA ' ' HB2' ' A' ' 93' ' ' LYS . 62.2 t -75.71 111.25 11.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.229 -0.656 . . . . 1.1799999999999999 109.229 175.223 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.493 HD13 ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER -113.67 110.53 32.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.911 0.862 . . . . 1.9399999999999999 110.487 -176.782 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.664 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 98.2 t -107.81 106.44 20.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 114.747 -1.115 . . . . 1.3700000000000001 108.945 175.596 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.759 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 40.4 t -151.55 155.13 37.84 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.344 0.592 . . . . 1.3100000000000001 111.792 -173.118 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.508 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 0.8 OUTLIER -62.02 -19.23 62.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.971 -1.013 . . . . 1.6699999999999999 111.66 176.269 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.445 ' OD1' ' HB3' ' A' ' 61' ' ' SER . 28.4 p-10 -63.78 -26.18 68.52 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.705 0.288 . . . . 1.8100000000000001 111.285 -179.182 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.548 ' HD2' HG22 ' A' ' 96' ' ' THR . 59.6 t80 -90.63 -13.2 34.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.439 0.638 . . . . 3.8700000000000001 109.674 176.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.508 ' HB3' ' HA ' ' A' ' 62' ' ' ASN . 0.9 OUTLIER -87.36 -11.03 50.54 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 108.878 -0.786 . . . . 2.1400000000000001 108.878 -179.668 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -63.31 -19.46 64.62 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.029 -0.987 . . . . 2.0299999999999998 110.451 178.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm 78.61 -28.28 0.16 Allowed 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.07 0.948 . . . . 3.8599999999999999 111.883 176.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -71.24 100.03 2.02 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.929 0.395 . . . . 2.4900000000000002 110.377 178.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.503 HD13 ' N ' ' A' ' 70' ' ' LEU . 4.0 pp -70.04 -36.31 74.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.277 -0.42 . . . . 2.8900000000000001 111.432 -175.312 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.503 ' N ' HD13 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -67.79 -32.96 73.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.801 0.334 . . . . 1.6000000000000001 110.942 178.951 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.536 ' HA ' ' HG2' ' A' ' 74' ' ' ARG . 7.2 m-20 -74.08 -37.73 64.13 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 120.888 0.375 . . . . 2.0800000000000001 110.126 177.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -57.64 -43.3 84.77 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.377 -0.601 . . . . 3.4199999999999999 109.377 172.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 30.7 t60 -63.42 -53.31 54.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.558 -0.746 . . . . 1.3700000000000001 111.143 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.536 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 9.9 ptm180 -63.69 -36.6 84.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.3 -0.409 . . . . 2.1000000000000001 111.6 -175.658 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -63.96 -49.48 72.34 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.77 0.319 . . . . 2.1299999999999999 110.773 178.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.402 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 74.6 t -58.57 -42.82 85.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.069 -0.514 . . . . 1.4099999999999999 110.297 176.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.524 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -64.3 -35.41 80.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.297 -0.41 . . . . 1.21 111.45 179.372 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 86.8 m -62.2 -51.33 68.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.838 0.351 . . . . 1.3200000000000001 111.446 -178.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.404 HD12 ' N ' ' A' ' 79' ' ' ILE . 2.9 mp -80.03 -48.88 19.87 Favored 'Isoleucine or valine' 0 C--O 1.241 0.617 0 CA-C-O 121.44 0.638 . . . . 1.46 110.927 -177.295 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.861 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.5 mp -74.94 -2.27 26.28 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.933 -0.576 . . . . 1.3799999999999999 111.441 -175.206 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.524 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 56.9 tptt -51.6 -64.1 0.92 Allowed 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 109.497 -0.557 . . . . 2.4199999999999999 109.497 171.208 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.422 ' HG3' ' N ' ' A' ' 83' ' ' GLU . 2.4 pt-20 -75.07 -33.68 61.71 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.001 -0.545 . . . . 2.9100000000000001 110.867 176.319 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.861 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 5.2 tp10 -55.18 -53.6 53.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.193 0.521 . . . . 1.6599999999999999 112.049 -175.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 70.3 mt -50.39 -30.67 12.91 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.269 -0.878 . . . . 1.27 112.472 178.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -57.21 -24.34 53.9 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.023 0.44 . . . . 0.96999999999999997 110.733 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -91.67 -10.82 38.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.064 -0.517 . . . . 1.02 111.47 -175.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.486 HD12 HG12 ' A' ' 29' ' ' ILE . 3.1 mt -120.46 164.13 17.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.746 -0.464 . . . . 1.3100000000000001 109.746 -176.667 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -92.24 -46.36 7.76 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.505 -0.554 . . . . 2.29 109.505 175.163 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -148.3 109.6 4.36 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.032 -0.531 . . . . 1.3999999999999999 110.514 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -116.77 127.41 54.32 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.295 -0.412 . . . . 0.63 110.547 177.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 37.0 p -124.44 167.07 14.92 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.412 -0.588 . . . . 1.9399999999999999 109.412 175.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -143.51 146.01 33.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.919 0.39 . . . . 1.27 111.132 -178.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.491 ' HB2' ' HA ' ' A' ' 58' ' ' VAL . 44.5 mmtm -97.42 109.35 22.12 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.003 -0.74 . . . . 2.71 109.003 174.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 3.9 p -89.9 111.56 22.65 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.062 -0.517 . . . . 2.0 111.018 -174.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.459 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 1.7 m80 -138.3 156.82 47.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.985 -0.552 . . . . 2.6099999999999999 110.671 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.548 HG22 ' HD2' ' A' ' 64' ' ' PHE . 47.5 p -98.16 153.47 38.09 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.225 -0.443 . . . . 1.27 110.272 177.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -64.39 -22.21 66.09 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.35 2.033 . . . . 1.0900000000000001 111.191 175.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -68.56 -44.0 75.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.262 -0.881 . . . . 2.6200000000000001 109.411 177.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 57.0 tt0 -75.9 -35.63 59.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.473 -0.785 . . . . 2.6899999999999999 110.132 178.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -58.43 -32.49 68.74 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.931 -0.577 . . . . 1.6100000000000001 110.957 178.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -52.03 -36.28 49.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.11 -0.495 . . . . 1.23 111.589 177.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -77.57 -35.43 53.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.101 0.477 . . . . 3.1499999999999999 110.167 178.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 66.3 mt . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.748 -0.66 . . . . 1.5900000000000001 111.709 -173.755 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.433 ' O ' HG21 ' A' ' 28' ' ' VAL . 62.3 m . . . . . 0 C--O 1.233 0.215 0 CA-C-O 120.761 0.315 . . . . 2.2000000000000002 111.391 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.1 tp -61.64 -38.39 80.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 116.165 -0.47 . . . . 1.8200000000000001 111.757 -176.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.2 tt0 -59.3 -43.11 92.65 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.086 0.469 . . . . 1.99 110.504 177.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -64.75 -34.55 78.6 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.532 -0.758 . . . . 2.9300000000000002 109.808 -179.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.433 HG21 ' O ' ' A' ' 24' ' ' CYS . 93.6 t -61.71 -43.95 97.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.993 -0.549 . . . . 1.6299999999999999 110.49 176.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.477 HD12 ' HB2' ' A' ' 86' ' ' ASN . 1.7 mp -67.22 -42.93 88.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.17 -0.468 . . . . 1.3300000000000001 110.535 178.213 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.521 ' O ' ' HB2' ' A' ' 34' ' ' SER . 45.1 mt-10 -52.21 -50.38 62.05 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.44 -0.345 . . . . 2.2000000000000002 111.036 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.423 ' HA ' ' HB3' ' A' ' 34' ' ' SER . 4.6 m-20 -78.79 -18.98 53.24 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.249 0.463 . . . . 1.6699999999999999 112.249 -178.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.432 ' HE3' HG22 ' A' ' 79' ' ' ILE . 51.5 tptt -61.46 -55.74 27.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.804 0.335 . . . . 2.5299999999999998 110.21 178.443 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.522 HD12 ' HG ' ' A' ' 42' ' ' LEU . 4.4 pp -73.68 -26.38 60.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.229 -0.442 . . . . 1.24 110.429 176.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.587 ' O ' ' HD2' ' A' ' 38' ' ' LYS . 4.7 t -63.7 -45.96 87.63 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 116.169 -0.468 . . . . 1.6599999999999999 109.907 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.8 m -53.27 -27.89 24.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.955 0.407 . . . . 0.79000000000000004 111.231 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.604 ' HB3' HG12 ' A' ' 79' ' ' ILE . . . -89.22 -43.35 11.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.937 -0.574 . . . . 1.24 112.316 -177.743 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.0 mp -107.06 -36.13 6.68 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.461 0.541 . . . . 1.49 112.461 -173.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.587 ' HD2' ' O ' ' A' ' 34' ' ' SER . 27.9 mmmt 51.01 75.3 0.67 Allowed Pre-proline 0 N--CA 1.468 0.443 0 C-N-CA 123.3 0.64 . . . . 3.8500000000000001 110.845 -168.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -81.97 141.66 12.01 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.716 2.277 . . . . 0.67000000000000004 112.391 -178.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.4 p -60.95 -35.05 75.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.594 -0.73 . . . . 1.3700000000000001 111.182 179.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.675 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 72.4 t80 -138.36 124.09 19.82 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.477 -0.564 . . . . 0.83999999999999997 109.477 175.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.522 ' HG ' HD12 ' A' ' 33' ' ' LEU . 3.3 tm? -142.54 122.62 13.71 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.748 -0.834 . . . . 2.1899999999999999 108.748 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.52 ' O ' ' HA ' ' A' ' 57' ' ' ALA . 10.7 tp10 -143.24 140.48 30.7 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.673 -0.411 . . . . 2.23 111.039 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.441 HD13 ' HG2' ' A' ' 30' ' ' GLU . 10.6 mp -106.74 117.41 33.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.086 0.47 . . . . 2.23 110.771 178.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 52.9 t -106.22 119.26 55.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.73 -0.668 . . . . 1.72 109.956 176.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -73.52 122.84 22.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.998 -0.546 . . . . 1.8300000000000001 110.101 177.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.7 mtmm . . . . . 0 C--N 1.324 -0.509 0 CA-C-N 116.283 -0.417 . . . . 3.2400000000000002 110.719 -177.986 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.7 p . . . . . 0 N--CA 1.446 -0.655 0 N-CA-C 109.29 -0.634 . . . . 2.04 109.29 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -111.33 132.7 54.2 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.184 0.516 . . . . 1.3 110.747 -175.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -112.59 118.55 35.4 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.191 -0.913 . . . . 1.3500000000000001 108.589 176.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.52 ' HA ' ' O ' ' A' ' 43' ' ' GLU . . . -105.68 115.6 30.52 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.999 0.428 . . . . 1.23 111.68 -173.404 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.406 ' O ' ' HA ' ' A' ' 42' ' ' LEU . 47.3 t -74.43 110.93 9.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 108.589 -0.893 . . . . 1.1799999999999999 108.589 172.389 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.461 HD12 ' HG ' ' A' ' 61' ' ' SER . 0.0 OUTLIER -107.65 109.68 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 CA-C-O 121.862 0.839 . . . . 1.9399999999999999 109.963 -177.687 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.675 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 60.2 t -111.26 105.21 18.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 115.026 -0.988 . . . . 1.3700000000000001 110.088 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.461 ' HG ' HD12 ' A' ' 59' ' ' ILE . 88.2 p -156.75 142.18 17.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.231 0.539 . . . . 1.3100000000000001 111.238 179.647 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.634 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 61.4 m-20 -67.69 -18.49 64.94 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.372 -0.831 . . . . 1.6699999999999999 112.07 177.529 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -48.99 -36.83 18.53 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.878 0.371 . . . . 1.8100000000000001 111.029 177.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.594 ' CE1' ' HA ' ' A' ' 72' ' ' ARG . 21.3 m-30 -101.59 21.4 14.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.955 0.407 . . . . 3.8700000000000001 111.286 -178.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.634 ' HB3' ' O ' ' A' ' 62' ' ' ASN . 0.7 OUTLIER -92.95 -14.57 27.34 Favored 'General case' 0 N--CA 1.426 -1.658 0 N-CA-C 108.407 -0.96 . . . . 2.1400000000000001 108.407 178.847 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -73.21 -4.02 30.39 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.365 -0.834 . . . . 2.0299999999999998 109.916 178.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 99.2 mttt 67.45 25.32 8.57 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.359 -0.837 . . . . 3.8599999999999999 111.888 172.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.469 ' HE2' HD11 ' A' ' 70' ' ' LEU . 13.5 mmmm -93.08 96.53 10.11 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.852 -0.613 . . . . 2.4900000000000002 109.896 178.172 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.463 HD12 ' N ' ' A' ' 70' ' ' LEU . 4.3 pp -72.35 -33.16 67.08 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.968 -0.293 . . . . 2.8900000000000001 110.977 -175.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.512 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.88 -35.16 78.02 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 120.957 -0.297 . . . . 1.6000000000000001 110.682 177.662 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.512 ' N ' HD22 ' A' ' 70' ' ' LEU . 23.0 m-20 -71.66 -45.32 62.32 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 109.567 -0.531 . . . . 2.0800000000000001 109.567 175.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.594 ' HA ' ' CE1' ' A' ' 64' ' ' PHE . 0.5 OUTLIER -52.88 -48.07 67.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.476 -0.784 . . . . 3.4199999999999999 110.033 175.497 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.6 t60 -65.94 -53.03 44.49 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.721 -0.672 . . . . 1.3700000000000001 111.315 -177.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -67.04 -41.65 86.17 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 111.961 0.356 . . . . 2.1000000000000001 111.961 -172.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.99 -49.98 70.33 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.929 0.395 . . . . 2.1299999999999999 110.315 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.757 HG12 HD22 ' A' ' 80' ' ' LEU . 35.0 t -57.74 -46.55 86.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.701 -0.681 . . . . 1.4099999999999999 110.635 178.188 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -61.84 -40.24 94.62 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.611 -0.268 . . . . 1.21 111.583 -178.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 74.8 m -60.99 -51.22 70.17 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 111.626 0.232 . . . . 1.3200000000000001 111.626 -177.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.604 HG12 ' HB3' ' A' ' 36' ' ' ALA . 2.7 mp -81.12 -48.84 18.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 CA-C-O 120.9 0.381 . . . . 1.46 111.295 -176.088 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.834 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.0 mp -69.8 -7.44 39.83 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 116.208 -0.451 . . . . 1.3799999999999999 111.669 -176.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -55.51 -59.71 4.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.273 0.559 . . . . 2.4199999999999999 109.951 171.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -68.64 -37.38 79.65 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.608 -0.724 . . . . 2.9100000000000001 110.178 177.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.834 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 32.9 tt0 -55.27 -41.22 71.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.743 -0.662 . . . . 1.6599999999999999 111.285 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.713 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 57.3 mt -54.84 -30.99 58.88 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 123.082 0.553 . . . . 1.27 112.402 179.426 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -60.2 -18.49 48.65 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.734 0.302 . . . . 0.96999999999999997 111.3 -174.149 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.477 ' HB2' HD12 ' A' ' 29' ' ' ILE . 25.8 m-80 -101.8 4.86 40.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.815 0.34 . . . . 1.02 110.929 -178.476 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 3.3 mt -127.32 163.81 29.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 110.102 -0.332 . . . . 1.3100000000000001 110.102 -175.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -96.55 -52.23 4.02 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.619 -0.511 . . . . 2.29 109.619 173.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -144.4 101.15 3.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.922 -0.581 . . . . 1.3999999999999999 110.311 177.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -93.31 141.47 28.4 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.279 -0.419 . . . . 0.63 110.944 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.5 m -138.38 163.58 31.5 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.742 -0.836 . . . . 1.9399999999999999 108.742 175.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -146.06 151.56 37.92 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.57 -0.452 . . . . 1.27 111.61 -178.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -113.81 116.32 29.16 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.56 -0.746 . . . . 2.71 109.481 176.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 42.5 t -84.23 124.19 30.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.71 0.29 . . . . 2.0 110.724 -177.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.658 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 2.1 t60 -147.99 152.72 37.95 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.868 -0.419 . . . . 2.6099999999999999 109.868 179.122 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.443 ' CG2' ' HB2' ' A' ' 65' ' ' GLU . 0.8 OUTLIER -102.19 151.89 38.16 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-O 120.76 0.314 . . . . 1.27 111.838 178.113 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -59.36 -48.04 14.96 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.999 2.466 . . . . 1.0900000000000001 112.247 -177.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.29 -36.12 81.13 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.83 -0.623 . . . . 2.6200000000000001 111.199 -177.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.555 ' HA ' ' CE ' ' A' ' 102' ' ' LYS . 20.1 tp10 -75.72 -38.51 58.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.773 0.32 . . . . 2.6899999999999999 110.627 -178.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -65.38 -33.25 75.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.871 0.367 . . . . 1.6100000000000001 110.093 176.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -54.48 -43.75 72.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.578 -0.737 . . . . 1.23 111.591 178.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.555 ' CE ' ' HA ' ' A' ' 99' ' ' GLU . 0.0 OUTLIER -61.99 -47.78 83.29 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 120.899 -0.32 . . . . 3.1499999999999999 110.708 177.72 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 62.4 mt . . . . . 0 C--N 1.324 -0.513 0 CA-C-N 116.181 -0.463 . . . . 1.5900000000000001 111.309 -176.003 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 34.7 m . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.599 0.238 . . . . 2.2000000000000002 110.814 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.3 tp -55.01 -34.15 30.89 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 CA-C-N 116.201 -0.454 . . . . 1.8200000000000001 111.157 -178.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 21.2 tm0? -58.83 -47.4 84.94 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.593 -0.276 . . . . 1.99 110.317 177.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.551 ' HA ' ' HB3' ' A' ' 30' ' ' GLU . 53.1 mttt -71.74 -17.82 62.17 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 116.426 -0.352 . . . . 2.9300000000000002 111.671 -178.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 95.3 t -67.25 -51.1 56.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 109.174 -0.676 . . . . 1.6299999999999999 109.174 174.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.584 ' HA ' ' OE2' ' A' ' 83' ' ' GLU . 2.0 mp -61.29 -51.33 74.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 115.135 -0.939 . . . . 1.3300000000000001 109.646 174.559 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.551 ' HB3' ' HA ' ' A' ' 27' ' ' LYS . 34.1 tt0 -53.06 -51.77 60.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.303 -0.862 . . . . 2.2000000000000002 111.564 -178.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -61.87 -45.52 93.41 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.974 -0.557 . . . . 1.6699999999999999 111.799 -174.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -68.42 -47.52 67.03 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.378 -0.529 . . . . 2.5299999999999998 112.24 -175.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.477 HD13 ' N ' ' A' ' 34' ' ' SER . 4.2 pp -70.8 -27.69 64.08 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.095 -0.642 . . . . 1.24 110.987 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.477 ' N ' HD13 ' A' ' 33' ' ' LEU . 46.5 t -66.66 -46.34 76.03 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.937 -0.394 . . . . 1.6599999999999999 109.937 175.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.8 m -71.35 -27.73 63.56 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.297 -0.41 . . . . 0.79000000000000004 111.337 -179.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.61 -43.17 20.96 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.082 0.401 . . . . 1.24 112.082 -176.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 85.8 mt -104.46 -38.05 6.95 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.724 0.268 . . . . 1.49 111.724 -174.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.3 mttm 53.6 90.37 0.09 OUTLIER Pre-proline 0 N--CA 1.467 0.384 0 CA-C-O 121.647 0.737 . . . . 3.8500000000000001 112.642 -175.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.804 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 5.2 Cg_endo -87.74 158.73 7.62 Favored 'Trans proline' 0 N--CA 1.451 -1.022 0 C-N-CA 123.155 2.57 . . . . 0.67000000000000004 112.047 175.024 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 21.6 p -82.77 -26.19 32.08 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.742 0.782 . . . . 1.3700000000000001 109.031 173.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.561 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 91.6 t80 -140.1 132.33 28.17 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.695 -1.139 . . . . 0.83999999999999997 109.268 173.542 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.563 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 59.3 tp -136.18 122.64 20.74 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.941 -0.392 . . . . 2.1899999999999999 109.941 -179.063 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.497 ' HB3' ' HB ' ' A' ' 58' ' ' VAL . 34.9 tt0 -119.88 119.86 34.75 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.432 -0.349 . . . . 2.23 110.061 -179.284 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -104.09 115.85 31.16 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.023 -0.362 . . . . 2.23 110.023 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 50.1 t -121.91 124.71 71.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.632 -0.258 . . . . 1.72 110.762 -178.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -82.07 122.63 28.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.113 0.482 . . . . 1.8300000000000001 109.984 174.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt . . . . . 0 C--N 1.319 -0.758 0 CA-C-N 115.874 -0.603 . . . . 3.2400000000000002 110.538 -178.487 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.524 ' HB3' ' O ' ' A' ' 89' ' ' ALA . 68.6 m . . . . . 0 N--CA 1.45 -0.431 0 N-CA-C 108.969 -0.752 . . . . 2.04 108.969 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.448 ' HB2' ' CD1' ' A' ' 90' ' ' PHE . 81.2 m-85 -111.57 132.66 54.39 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.599 0.714 . . . . 1.3 111.385 -170.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -110.81 113.85 26.75 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 107.702 -1.221 . . . . 1.3500000000000001 107.702 173.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.34 116.12 31.39 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.298 0.571 . . . . 1.23 111.382 -173.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.497 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 44.8 t -83.61 111.12 19.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 108.791 -0.818 . . . . 1.1799999999999999 108.791 174.462 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.423 HG21 ' HA ' ' A' ' 94' ' ' CYS . 0.0 OUTLIER -110.14 107.84 23.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 121.876 0.846 . . . . 1.9399999999999999 110.553 -176.207 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.561 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 94.4 t -107.72 108.01 24.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 114.86 -1.063 . . . . 1.3700000000000001 109.013 176.253 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.804 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 45.2 t -151.36 154.78 37.35 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.254 0.549 . . . . 1.3100000000000001 112.112 -173.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.488 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 14.9 m120 -66.53 -19.44 65.78 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.233 -0.894 . . . . 1.6699999999999999 110.27 174.126 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -64.69 -20.79 66.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.916 -0.584 . . . . 1.8100000000000001 110.537 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -110.47 7.01 22.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.36 0.6 . . . . 3.8700000000000001 110.042 178.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.488 ' HB3' ' O ' ' A' ' 62' ' ' ASN . 0.5 OUTLIER -76.69 -28.34 55.88 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 109.347 -0.612 . . . . 2.1400000000000001 109.347 -177.008 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -71.72 -8.57 54.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.815 -0.63 . . . . 2.0299999999999998 110.225 172.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 54.6 mttp 65.73 29.44 10.7 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.384 -0.826 . . . . 3.8599999999999999 112.165 171.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.432 ' HB3' ' OD2' ' A' ' 71' ' ' ASP . 14.2 mmmm -90.71 96.11 10.48 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.024 0.44 . . . . 2.4900000000000002 109.974 175.571 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.437 HD13 ' N ' ' A' ' 70' ' ' LEU . 3.8 pp -73.48 -36.77 65.86 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.98 -0.555 . . . . 2.8900000000000001 111.521 -174.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.447 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.87 -32.26 72.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.717 0.294 . . . . 1.6000000000000001 110.972 178.496 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.447 ' N ' HD22 ' A' ' 70' ' ' LEU . 4.1 m-20 -66.84 -49.39 65.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.914 0.388 . . . . 2.0800000000000001 110.666 -179.533 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.426 ' HG3' ' O ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -66.08 -26.83 67.66 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.827 -0.349 . . . . 3.4199999999999999 110.344 178.724 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -69.51 -50.03 49.01 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 116.278 -0.419 . . . . 1.3700000000000001 111.001 -179.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.415 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 11.6 ptm180 -66.7 -36.31 82.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.66 -0.245 . . . . 2.1000000000000001 111.169 -178.418 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.84 -50.59 55.83 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 120.711 0.291 . . . . 2.1299999999999999 111.034 177.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.541 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 8.9 p -61.77 -35.4 67.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.298 0 CA-C-N 116.496 -0.32 . . . . 1.4099999999999999 110.25 -179.087 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.585 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -69.62 -33.66 72.96 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.625 -0.261 . . . . 1.21 110.996 177.741 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 66.8 m -59.48 -51.72 68.66 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.707 0.289 . . . . 1.3200000000000001 111.344 179.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.0 mp -83.18 -47.55 18.2 Favored 'Isoleucine or valine' 0 C--O 1.244 0.796 0 CA-C-O 121.681 0.753 . . . . 1.46 111.149 -177.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.778 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.3 mp -77.31 -0.45 25.54 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.176 -0.466 . . . . 1.3799999999999999 112.121 -173.679 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.585 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 56.9 tptt -58.68 -57.77 11.54 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.26 -0.644 . . . . 2.4199999999999999 109.26 171.824 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -72.15 -34.12 68.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.3 -0.863 . . . . 2.9100000000000001 109.99 177.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.778 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.7 tp10 -54.86 -51.03 67.21 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.628 -0.714 . . . . 1.6599999999999999 112.468 178.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 52.7 mt -50.35 -30.42 12.15 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.283 -0.871 . . . . 1.27 113.252 -176.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -53.73 -19.63 4.43 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.269 0.47 . . . . 0.96999999999999997 112.269 -174.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -101.86 -4.0 27.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.77 0.319 . . . . 1.02 111.54 -177.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.46 HD12 HG12 ' A' ' 29' ' ' ILE . 12.6 mt -114.94 151.7 16.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.482 -0.326 . . . . 1.3100000000000001 110.136 -174.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -84.99 -55.23 4.16 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.804 -0.358 . . . . 2.29 110.099 177.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.524 ' O ' ' HB3' ' A' ' 54' ' ' SER . . . -144.16 91.22 2.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.937 0.399 . . . . 1.3999999999999999 111.185 178.292 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . 0.448 ' CD1' ' HB2' ' A' ' 55' ' ' PHE . 63.7 t80 -86.4 141.41 29.18 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.323 -0.399 . . . . 0.63 110.002 177.067 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 8.8 m -141.04 158.56 43.77 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.372 -0.603 . . . . 1.9399999999999999 109.372 177.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -138.65 147.14 42.51 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.932 0.396 . . . . 1.27 111.124 -179.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -115.97 109.54 17.71 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.664 -0.698 . . . . 2.71 109.725 175.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.423 ' HA ' HG21 ' A' ' 59' ' ' ILE . 7.9 p -85.6 123.82 31.45 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.719 0.295 . . . . 2.0 110.623 -177.707 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.494 ' HD2' ' HG2' ' A' ' 99' ' ' GLU . 3.7 m80 -144.0 160.52 40.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.165 0.507 . . . . 2.6099999999999999 110.99 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.441 ' CG2' ' HA ' ' A' ' 65' ' ' GLU . 11.5 p -102.75 153.69 38.03 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 115.489 -0.778 . . . . 1.27 111.132 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -58.12 -28.76 84.9 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.721 2.281 . . . . 1.0900000000000001 111.69 175.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.53 -47.16 76.75 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.896 -0.593 . . . . 2.6200000000000001 110.285 177.599 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.494 ' HG2' ' HD2' ' A' ' 95' ' ' HIS . 6.4 tp10 -67.05 -51.82 49.82 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.629 -0.714 . . . . 2.6899999999999999 110.657 179.38 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -62.11 -32.39 72.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.917 -0.583 . . . . 1.6100000000000001 110.966 -176.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -55.42 -33.24 63.37 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.035 -0.53 . . . . 1.23 111.072 178.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.429 ' N ' ' HE3' ' A' ' 102' ' ' LYS . 0.6 OUTLIER -76.55 -43.51 38.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.971 0.415 . . . . 3.1499999999999999 110.223 176.8 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 86.2 mt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 115.799 -0.637 . . . . 1.5900000000000001 111.492 -175.838 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.501 ' O ' HG22 ' A' ' 28' ' ' VAL . 42.4 t . . . . . 0 N--CA 1.454 -0.232 0 N-CA-C 108.646 -0.872 . . . . 2.2000000000000002 108.646 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.538 ' O ' HG12 ' A' ' 29' ' ' ILE . 8.7 tp -53.07 -38.2 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 O-C-N 123.501 0.501 . . . . 1.8200000000000001 111.626 -175.531 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -62.01 -52.26 64.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.807 0.337 . . . . 1.99 110.614 179.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -64.97 -31.45 72.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.101 -0.5 . . . . 2.9300000000000002 110.774 -178.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.501 HG22 ' O ' ' A' ' 24' ' ' CYS . 89.5 t -61.79 -46.45 96.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 110.125 -0.324 . . . . 1.6299999999999999 110.125 175.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.578 HG22 HD11 ' A' ' 87' ' ' ILE . 51.3 mm -63.14 -43.07 98.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.132 -0.486 . . . . 1.3300000000000001 110.342 177.283 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -54.18 -51.94 62.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.982 -0.553 . . . . 2.2000000000000002 111.005 177.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.441 ' HA ' ' HG ' ' A' ' 34' ' ' SER . 16.5 t70 -67.65 -34.55 77.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.183 0.516 . . . . 1.6699999999999999 111.007 -179.55 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.518 ' HG2' ' OE1' ' A' ' 83' ' ' GLU . 13.5 tptp -60.18 -55.89 28.31 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.517 -0.765 . . . . 2.5299999999999998 111.388 -177.423 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -74.16 -29.76 61.93 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.984 -0.286 . . . . 1.24 111.722 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.441 ' HG ' ' HA ' ' A' ' 31' ' ' ASP . 73.6 p -72.04 -33.4 67.97 Favored 'General case' 0 C--O 1.224 -0.248 0 C-N-CA 121.089 -0.244 . . . . 1.6599999999999999 111.241 -177.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.2 m -65.79 -27.32 68.19 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.826 0.346 . . . . 0.79000000000000004 111.042 176.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.29 -49.47 6.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.385 -0.37 . . . . 1.24 111.672 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.6 mt -83.11 -30.15 28.16 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.855 0.317 . . . . 1.49 111.855 -177.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 16.3 mmtm 55.68 81.82 0.25 Allowed Pre-proline 0 N--CA 1.466 0.329 0 C-N-CA 123.175 0.59 . . . . 3.8500000000000001 112.331 -176.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.661 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 69.0 Cg_endo -92.62 139.23 1.81 Allowed 'Trans proline' 0 N--CA 1.448 -1.195 0 C-N-CA 122.887 2.392 . . . . 0.67000000000000004 111.947 174.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 13.7 p -68.41 -32.5 72.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.22 0.533 . . . . 1.3700000000000001 110.298 176.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.481 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 69.1 t80 -141.97 131.76 24.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.491 -0.777 . . . . 0.83999999999999997 109.472 176.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.7 tp -141.87 112.87 7.41 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.756 0.312 . . . . 2.1899999999999999 110.535 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -125.74 139.17 53.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.493 -0.321 . . . . 2.23 110.322 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.447 ' HG ' ' HB3' ' A' ' 57' ' ' ALA . 7.2 mp -117.12 122.41 44.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.541 -0.3 . . . . 2.23 110.497 -178.434 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.423 HG21 ' HB3' ' A' ' 56' ' ' ASP . 9.6 m -112.75 150.79 14.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.017 0.437 . . . . 1.72 111.135 178.115 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -78.28 119.58 21.84 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.793 -0.64 . . . . 1.8300000000000001 110.235 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 21.5 ttmm . . . . . 0 C--N 1.324 -0.534 0 CA-C-N 116.223 -0.444 . . . . 3.2400000000000002 109.862 -179.893 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.0 p . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 120.733 0.301 . . . . 2.04 110.711 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -111.63 132.74 54.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.415 -0.357 . . . . 1.3 110.621 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.423 ' HB3' HG21 ' A' ' 45' ' ' VAL . 5.2 t70 -107.76 110.37 22.17 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.33 -0.619 . . . . 1.3500000000000001 109.33 179.08 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.447 ' HB3' ' HG ' ' A' ' 44' ' ' LEU . . . -106.17 115.8 30.84 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.99 0.424 . . . . 1.23 111.315 -177.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 56.2 t -82.02 111.18 18.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.81 -0.632 . . . . 1.1799999999999999 109.32 175.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -104.41 108.8 25.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.667 0.746 . . . . 1.9399999999999999 110.13 -176.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.605 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 60.4 t -106.5 106.67 21.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.175 -0.92 . . . . 1.3700000000000001 109.27 177.13 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.661 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 30.0 t -142.31 147.93 37.17 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.012 0.434 . . . . 1.3100000000000001 112.081 -174.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.614 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 25.0 m120 -67.13 -20.68 65.8 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.5 -0.773 . . . . 1.6699999999999999 110.891 174.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -61.51 -23.96 66.28 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.939 -0.573 . . . . 1.8100000000000001 111.154 -177.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -100.65 -5.3 26.82 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.476 -0.329 . . . . 3.8700000000000001 111.477 -175.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.614 ' HG2' ' O ' ' A' ' 62' ' ' ASN . 7.7 pt-20 -77.58 -2.17 34.42 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 120.401 -0.52 . . . . 2.1400000000000001 111.457 -174.11 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -92.86 4.49 53.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.227 0.536 . . . . 2.0299999999999998 109.939 176.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt 71.82 15.21 5.85 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.18 -0.918 . . . . 3.8599999999999999 111.062 175.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm -76.39 89.7 3.21 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.195 0.522 . . . . 2.4900000000000002 110.963 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -73.92 -50.01 22.09 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.609 -0.723 . . . . 2.8900000000000001 109.899 179.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.514 HD23 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.61 -34.58 77.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.117 -0.492 . . . . 1.6000000000000001 111.215 -175.754 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.514 ' N ' HD23 ' A' ' 70' ' ' LEU . 9.4 t70 -73.76 -37.03 65.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.316 0.579 . . . . 2.0800000000000001 109.878 -178.559 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.42 ' O ' HG22 ' A' ' 76' ' ' VAL . 1.3 tmt_? -63.42 -41.88 98.71 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.752 -0.658 . . . . 3.4199999999999999 110.018 172.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -63.02 -47.01 84.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.089 -0.505 . . . . 1.3700000000000001 111.155 -178.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.469 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 3.5 ptm180 -66.18 -35.66 81.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.466 -0.334 . . . . 2.1000000000000001 110.963 -177.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.84 -48.34 71.96 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 110.244 -0.28 . . . . 2.1299999999999999 110.244 176.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.531 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 64.6 t -56.92 -42.49 78.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.083 -0.508 . . . . 1.4099999999999999 110.678 177.292 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.91 -42.95 94.31 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.989 -0.284 . . . . 1.21 111.548 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 57.4 m -65.92 -49.09 69.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.03 0.443 . . . . 1.3200000000000001 111.349 -176.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.412 ' HB ' HD11 ' A' ' 80' ' ' LEU . 35.1 mt -72.4 -53.37 19.66 Favored 'Isoleucine or valine' 0 C--O 1.241 0.643 0 CA-C-O 121.742 0.782 . . . . 1.46 110.708 -178.329 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 1.024 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.4 mp -79.57 -0.31 33.05 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.175 -0.92 . . . . 1.3799999999999999 111.965 -172.435 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -53.81 -63.92 0.99 Allowed 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.475 -0.49 . . . . 2.4199999999999999 109.688 173.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -75.76 -33.08 60.21 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.096 -0.502 . . . . 2.9100000000000001 110.884 173.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 1.024 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 1.8 tp10 -52.83 -52.88 55.35 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.787 0.327 . . . . 1.6599999999999999 111.683 -177.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.652 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 61.9 mt -50.49 -30.83 13.71 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.48 -0.782 . . . . 1.27 112.465 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -57.81 -22.38 47.15 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 120.745 0.307 . . . . 0.96999999999999997 111.077 -177.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -90.47 -7.01 54.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.811 0.338 . . . . 1.02 111.174 -178.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.578 HD11 HG22 ' A' ' 29' ' ' ILE . 6.9 mt -123.72 135.45 63.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.504 -0.316 . . . . 1.3100000000000001 110.498 -174.283 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -69.33 -46.74 66.34 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.561 -0.533 . . . . 2.29 109.561 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -151.94 101.36 2.73 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.239 -0.437 . . . . 1.3999999999999999 110.947 178.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . 0.508 ' HB2' HG21 ' A' ' 87' ' ' ILE . 79.1 t80 -103.01 139.28 38.77 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.944 0.402 . . . . 0.63 111.028 178.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.7 m -135.19 149.49 49.94 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.32 -0.622 . . . . 1.9399999999999999 109.32 174.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -134.42 134.23 41.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.106 0.479 . . . . 1.27 111.105 -178.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -106.48 116.74 32.46 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.805 -0.634 . . . . 2.71 109.377 177.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 7.2 p -83.62 129.39 34.96 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.016 0.436 . . . . 2.0 111.613 -175.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.605 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 0.1 OUTLIER -145.09 158.23 43.88 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.802 -0.636 . . . . 2.6099999999999999 109.67 176.063 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -112.03 153.99 44.39 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 116.413 -0.358 . . . . 1.27 111.627 -178.507 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -61.89 -26.86 79.48 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 123.11 2.54 . . . . 1.0900000000000001 112.724 -176.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 98' ' ' LEU . 1.2 tm? -62.45 -51.41 67.62 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.777 -0.453 . . . . 2.6200000000000001 109.777 -178.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.55 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 6.4 mp0 -66.82 -38.8 87.17 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.38 -0.373 . . . . 2.6899999999999999 111.0 177.168 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -59.42 -39.72 84.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.586 -0.279 . . . . 1.6100000000000001 111.05 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -58.46 -34.43 70.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 1.23 110.524 179.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.704 ' HE2' ' N ' ' A' ' 102' ' ' LYS . 0.6 OUTLIER -76.44 -35.47 58.48 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.399 -0.364 . . . . 3.1499999999999999 110.537 178.455 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 69.8 mt . . . . . 0 N--CA 1.463 0.206 0 CA-C-N 115.94 -0.573 . . . . 1.5900000000000001 111.396 -178.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 37.8 m . . . . . 0 N--CA 1.451 -0.401 0 N-CA-C 109.788 -0.449 . . . . 2.2000000000000002 109.788 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 11.2 tp -61.24 -32.03 51.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.611 0.243 . . . . 1.8200000000000001 110.899 -176.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.448 ' HA ' ' OE1' ' A' ' 26' ' ' GLN . 6.4 tp60 -63.14 -37.2 86.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.97 0.414 . . . . 1.99 110.683 179.392 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -71.59 -33.8 69.33 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.226 -0.443 . . . . 2.9300000000000002 110.054 177.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.403 HG11 ' HE3' ' A' ' 32' ' ' LYS . 62.2 t -61.45 -50.91 78.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.968 -0.56 . . . . 1.6299999999999999 110.194 177.27 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.482 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.7 mp -58.39 -50.21 79.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.804 -0.635 . . . . 1.3300000000000001 110.149 176.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -53.46 -52.03 60.81 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.727 -0.669 . . . . 2.2000000000000002 111.579 -178.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.8 -42.22 77.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 1.6699999999999999 112.138 -173.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.403 ' HE3' HG11 ' A' ' 28' ' ' VAL . 8.4 mtmp? -66.88 -45.71 77.19 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.595 -0.442 . . . . 2.5299999999999998 111.564 -175.127 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 4.5 pp -72.31 -28.27 62.97 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.197 -0.601 . . . . 1.24 110.999 177.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.437 ' N ' HD11 ' A' ' 33' ' ' LEU . 46.3 t -66.0 -41.82 90.56 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.982 0.42 . . . . 1.6599999999999999 109.901 175.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.7 m -66.93 -27.65 67.65 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.111 0.482 . . . . 0.79000000000000004 110.686 179.021 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.447 ' HB1' HG12 ' A' ' 79' ' ' ILE . . . -77.15 -53.91 7.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.807 -0.633 . . . . 1.24 111.87 -178.613 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.3 mt -86.79 -26.38 24.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.439 -0.346 . . . . 1.49 111.465 -174.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.2 tttp 56.67 75.12 0.6 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.771 -0.65 . . . . 3.8500000000000001 110.964 -176.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.622 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 23.5 Cg_endo -94.45 144.47 1.66 Allowed 'Trans proline' 0 N--CA 1.448 -1.154 0 C-N-CA 123.29 2.66 . . . . 0.67000000000000004 112.566 179.141 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 23.9 p -80.58 -23.76 39.66 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.424 0.63 . . . . 1.3700000000000001 109.489 174.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.755 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 76.5 t80 -139.25 125.21 19.81 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.005 -0.998 . . . . 0.83999999999999997 109.248 175.272 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -142.23 118.73 10.94 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.323 -0.621 . . . . 2.1899999999999999 109.323 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -131.55 131.89 43.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.518 -0.31 . . . . 2.23 110.908 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -89.55 115.59 27.07 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.975 -0.75 . . . . 2.23 108.975 176.004 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 44.6 t -107.17 132.21 55.19 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.024 0.44 . . . . 1.72 111.502 -175.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.28 100.93 0.38 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.515 -0.766 . . . . 1.8300000000000001 109.255 172.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.496 ' HD3' ' HB3' ' A' ' 56' ' ' ASP . 27.4 tptt . . . . . 0 C--N 1.324 -0.538 0 CA-C-O 121.013 0.435 . . . . 3.2400000000000002 109.985 -176.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.0 m . . . . . 0 N--CA 1.451 -0.407 0 N-CA-C 110.142 -0.318 . . . . 2.04 110.142 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -111.55 132.42 54.54 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.719 -0.845 . . . . 1.3 108.719 175.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.496 ' HB3' ' HD3' ' A' ' 47' ' ' LYS . 35.1 t70 -115.56 125.94 53.6 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.947 -0.39 . . . . 1.3500000000000001 109.947 -175.183 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.15 115.95 31.1 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.199 0.523 . . . . 1.23 111.273 -174.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 62.0 t -78.09 111.85 15.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.391 -0.822 . . . . 1.1799999999999999 109.061 174.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.531 ' CG1' ' HA ' ' A' ' 94' ' ' CYS . 0.9 OUTLIER -105.16 133.89 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-O 121.234 0.54 . . . . 1.9399999999999999 110.356 -177.559 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.755 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 96.9 t -124.91 101.48 8.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 N-CA-C 108.618 -0.882 . . . . 1.3700000000000001 108.618 172.125 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.622 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 37.1 t -151.7 154.97 37.37 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.186 -0.461 . . . . 1.3100000000000001 111.376 -173.211 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.46 -18.97 65.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.935 -0.575 . . . . 1.6699999999999999 110.519 174.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -63.42 -1.93 1.34 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 122.804 0.442 . . . . 1.8100000000000001 112.022 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.586 ' HD2' HG21 ' A' ' 96' ' ' THR . 51.6 t80 -109.69 -7.14 15.12 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.983 -0.448 . . . . 3.8700000000000001 111.528 179.643 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -75.5 -18.2 59.9 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.688 -0.405 . . . . 2.1400000000000001 111.606 -171.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.481 ' O ' ' HG2' ' A' ' 67' ' ' LYS . 8.7 m-20 -75.59 -15.41 60.36 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.828 -0.169 . . . . 2.0299999999999998 110.847 175.49 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 66' ' ' ASP . 62.3 pttt 53.6 13.85 0.53 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.759 1.224 . . . . 3.8599999999999999 113.21 178.482 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -78.82 125.32 29.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.209 0.528 . . . . 2.4900000000000002 111.276 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 28.0 tp -69.7 -56.67 6.57 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.311 -0.858 . . . . 2.8900000000000001 111.1 -179.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.98 -31.16 72.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.717 -0.674 . . . . 1.6000000000000001 112.125 -171.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.405 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 12.4 t70 -73.76 -45.46 51.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.056 0.455 . . . . 2.0800000000000001 110.636 -174.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 12.9 ptt180 -72.49 -31.78 65.65 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.658 -0.497 . . . . 3.4199999999999999 109.658 178.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -60.67 -50.93 71.54 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.086 -0.506 . . . . 1.3700000000000001 110.349 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -63.88 -40.46 96.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.52 -0.309 . . . . 2.1000000000000001 111.23 -178.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 89.0 mt -65.09 -50.24 66.89 Favored 'General case' 0 C--O 1.243 0.715 0 CA-C-O 121.122 0.486 . . . . 2.1299999999999999 110.754 179.529 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.54 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 47.1 t -55.65 -45.34 78.99 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.586 0 CA-C-N 115.494 -0.776 . . . . 1.4099999999999999 110.568 178.093 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -66.96 -27.37 67.4 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 121.007 -0.277 . . . . 1.21 111.431 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 96.4 m -63.19 -54.02 44.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.541 0.21 . . . . 1.3200000000000001 110.943 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.447 HG12 ' HB1' ' A' ' 36' ' ' ALA . 3.3 mp -82.19 -42.29 18.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 CA-C-O 121.63 0.728 . . . . 1.46 111.006 -178.646 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.843 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.5 mp -76.49 -0.99 25.04 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.041 -0.527 . . . . 1.3799999999999999 111.757 -176.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 51.5 tptt -51.56 -63.37 1.15 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.379 -0.6 . . . . 2.4199999999999999 109.379 169.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -74.63 -34.9 62.88 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.162 -0.472 . . . . 2.9100000000000001 110.989 176.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.843 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 5.5 tp10 -52.55 -55.4 22.48 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.387 0.613 . . . . 1.6599999999999999 111.975 -178.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 65.8 mt -50.51 -30.87 13.92 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 115.174 -0.921 . . . . 1.27 112.756 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -56.64 -23.15 39.37 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.901 0.381 . . . . 0.96999999999999997 111.098 -176.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -96.54 -1.19 47.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.132 -0.485 . . . . 1.02 111.447 -176.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 6.9 mt -127.78 142.32 44.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 110.409 -0.219 . . . . 1.3100000000000001 110.409 -177.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 86.0 t60 -69.98 -56.8 6.04 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.657 -0.417 . . . . 2.29 110.029 175.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -143.07 104.09 4.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.119 -0.491 . . . . 1.3999999999999999 110.533 179.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -92.15 133.27 35.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.15 0.5 . . . . 0.63 110.811 177.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 42.5 t -121.04 155.73 33.73 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.178 -0.675 . . . . 1.9399999999999999 109.178 177.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -143.51 138.97 29.57 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.867 0.365 . . . . 1.27 110.585 -177.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -112.47 109.06 18.43 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.562 -0.533 . . . . 2.71 109.562 174.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.531 ' HA ' ' CG1' ' A' ' 59' ' ' ILE . 37.6 m -84.01 111.65 19.48 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.829 -0.623 . . . . 2.0 110.863 -174.256 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -132.05 157.69 43.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.091 0.472 . . . . 2.6099999999999999 111.063 177.041 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.586 HG21 ' HD2' ' A' ' 64' ' ' PHE . 48.0 p -102.52 159.54 29.04 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.174 -0.467 . . . . 1.27 110.339 176.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . 0.529 ' HG2' HD23 ' A' ' 98' ' ' LEU . 18.3 Cg_endo -60.71 -37.26 80.28 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.582 2.188 . . . . 1.0900000000000001 111.928 177.363 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.529 HD23 ' HG2' ' A' ' 97' ' ' PRO . 2.9 mm? -69.67 -32.64 71.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.109 -0.496 . . . . 2.6200000000000001 110.362 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 76.6 tt0 -72.17 -50.8 24.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.086 0.47 . . . . 2.6899999999999999 110.028 177.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -62.94 -35.21 79.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.762 -0.654 . . . . 1.6100000000000001 111.607 -176.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -60.74 -33.0 72.26 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.873 0.368 . . . . 1.23 111.372 -178.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.64 ' HE2' ' N ' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -78.18 -22.54 48.48 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.851 0.357 . . . . 3.1499999999999999 110.638 177.729 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 91.2 mt . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 116.204 -0.453 . . . . 1.5900000000000001 111.092 -178.704 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.2 tpp . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 110.034 -0.358 . . . . 36.359999999999999 110.034 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 165.46 -124.08 1.21 Allowed Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 111.622 -0.591 . . . . 33.770000000000003 111.622 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.3 m 62.63 25.77 15.31 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.643 0.377 . . . . 32.670000000000002 111.678 177.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.7 t -90.44 111.3 22.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.146 0.498 . . . . 30.75 110.914 -178.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -146.97 95.82 2.64 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.138 -0.69 . . . . 28.739999999999998 109.138 174.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -90.91 138.39 31.63 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.912 -0.585 . . . . 29.030000000000001 111.457 -172.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.5 p-80 -86.04 75.42 9.95 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.825 0.821 . . . . 26.800000000000001 110.329 175.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 74.0 t60 -72.95 122.39 21.61 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.87 -1.059 . . . . 24.5 109.835 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 39.0 m170 -72.42 -65.84 0.73 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.012 0.434 . . . . 24.210000000000001 110.888 -174.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -166.46 123.29 1.3 Allowed 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.742 -0.836 . . . . 20.899999999999999 108.742 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.3 m -53.49 -53.91 44.68 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 123.528 0.518 . . . . 20.109999999999999 112.374 -170.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.9 m 58.33 48.1 12.96 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.483 0.659 . . . . 17.379999999999999 109.537 -178.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -168.52 -29.38 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 CA-C-N 115.316 -0.856 . . . . 16.75 112.832 -176.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 47.3 mtp180 -97.12 -30.7 12.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.571 0.701 . . . . 19.629999999999999 109.324 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -87.72 19.76 3.3 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.929 -1.032 . . . . 14.57 111.005 -177.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -71.21 -1.86 14.02 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.14 -0.482 . . . . 16.100000000000001 111.691 -175.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.9 mp -82.16 -22.79 35.89 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.421 -0.354 . . . . 16.719999999999999 111.454 -178.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 40.0 m-85 -95.54 131.77 41.37 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.421 0.629 . . . . 15.609999999999999 112.061 -176.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -95.67 12.65 29.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.878 -1.055 . . . . 11.970000000000001 110.9 -178.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -82.98 31.31 0.43 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.729 -0.668 . . . . 10.890000000000001 111.674 -175.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.33 0.11 89.37 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.983 -0.627 . . . . 7.0 111.995 176.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 61.1 t60 -79.26 131.33 36.13 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.822 -0.436 . . . . 6.5999999999999996 109.822 177.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.2 mmt -61.79 122.24 14.89 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.481 0.658 . . . . 4.7999999999999998 111.913 -174.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.9 t -161.01 168.15 25.06 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.759 -1.11 . . . . 2.2000000000000002 108.378 -178.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.8 tp -56.7 -35.77 46.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 120.874 0.369 . . . . 1.8200000000000001 110.855 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -65.91 -40.09 91.17 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.255 -0.429 . . . . 1.99 110.544 178.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.713 ' HZ1' ' HB2' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -61.49 -40.91 96.26 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.787 -0.642 . . . . 2.9300000000000002 110.447 -178.704 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 54.8 t -63.47 -55.38 23.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.9 -0.591 . . . . 1.6299999999999999 110.857 -178.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.7 mp -58.22 -47.42 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.112 -0.494 . . . . 1.3300000000000001 110.878 -179.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.18 -51.26 68.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.085 -0.507 . . . . 2.2000000000000002 111.121 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.713 ' HB2' ' HZ1' ' A' ' 27' ' ' LYS . 30.4 t70 -66.9 -34.51 77.94 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.479 -0.328 . . . . 1.6699999999999999 111.33 -176.104 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.802 ' HB3' ' HZ1' ' A' ' 32' ' ' LYS . 10.1 mtpm? -63.5 -55.47 23.8 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 111.836 0.31 . . . . 2.5299999999999998 111.836 -177.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.433 HD12 ' N ' ' A' ' 34' ' ' SER . 3.8 pp -70.46 -28.42 64.99 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.896 -0.322 . . . . 1.24 111.058 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.433 ' N ' HD12 ' A' ' 33' ' ' LEU . 19.6 t -65.37 -39.5 92.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.931 0.396 . . . . 1.6599999999999999 110.558 178.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.1 m -67.83 -28.07 67.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.387 -0.37 . . . . 0.79000000000000004 111.363 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.11 -54.96 3.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.309 -0.405 . . . . 1.24 111.961 -174.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.51 HD13 ' HZ ' ' A' ' 64' ' ' PHE . 65.9 mt -87.94 -16.72 33.04 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.707 0.289 . . . . 1.49 111.06 -175.263 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.5 mttp 49.55 76.39 0.55 Allowed Pre-proline 0 C--O 1.235 0.324 0 CA-C-N 115.348 -0.842 . . . . 3.8500000000000001 112.635 178.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.551 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 51.5 Cg_endo -89.27 126.68 1.64 Allowed 'Trans proline' 0 N--CA 1.447 -1.259 0 C-N-CA 122.687 2.258 . . . . 0.67000000000000004 111.769 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.3 p -63.16 -25.54 68.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.118 0.485 . . . . 1.3700000000000001 110.966 177.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.689 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 89.3 t80 -141.76 141.62 33.23 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.617 -0.72 . . . . 0.83999999999999997 109.491 175.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 45.7 tp -142.16 116.83 9.76 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.977 -0.379 . . . . 2.1899999999999999 109.977 178.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' A' ' 57' ' ' ALA . 5.7 tp10 -105.47 130.05 53.63 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 110.036 -0.357 . . . . 2.23 110.036 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.9 mp -118.44 115.8 25.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.116 0.484 . . . . 2.23 110.82 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 44.1 t -122.13 144.04 32.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.861 -0.609 . . . . 1.72 110.108 179.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -72.67 115.01 11.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.134 0.492 . . . . 1.8300000000000001 110.602 176.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.496 ' O ' ' HB2' ' A' ' 54' ' ' SER . 0.0 OUTLIER -131.64 78.88 1.85 Allowed 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 107.794 -1.187 . . . . 3.2400000000000002 107.794 174.481 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.601 ' HA ' ' HB2' ' A' ' 54' ' ' SER . 50.3 m -66.32 129.79 41.03 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.179 -0.919 . . . . 3.3799999999999999 111.052 -174.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 42.2 t -67.76 -22.45 65.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.739 -0.664 . . . . 5.1600000000000001 110.58 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 139.39 -37.42 1.75 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.966 -0.635 . . . . 3.3300000000000001 111.53 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.8 t -109.03 98.48 7.94 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.871 0.367 . . . . 4.6299999999999999 110.033 177.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.75 178.49 50.44 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.989 -0.625 . . . . 2.7599999999999998 112.801 177.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.2 m -67.57 139.19 56.9 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.263 0.554 . . . . 3.98 111.357 -179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.601 ' HB2' ' HA ' ' A' ' 48' ' ' SER . 14.1 m -136.32 146.49 46.64 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.836 -0.801 . . . . 2.04 108.836 176.144 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -111.47 132.84 54.19 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.12 0.486 . . . . 1.3 110.774 -173.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.502 ' CG ' ' HZ2' ' A' ' 93' ' ' LYS . 4.2 t70 -117.48 108.72 15.86 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.319 -0.993 . . . . 1.3500000000000001 108.319 175.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.481 ' HA ' ' O ' ' A' ' 43' ' ' GLU . . . -111.15 124.91 53.13 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.14 0.495 . . . . 1.23 112.08 -171.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.481 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 58.6 t -90.02 116.74 31.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.641 -0.709 . . . . 1.1799999999999999 109.421 174.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.641 HG12 ' HA ' ' A' ' 94' ' ' CYS . 2.5 pt -97.42 145.29 9.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 121.146 0.498 . . . . 1.9399999999999999 110.77 -176.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.689 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 89.1 t -131.63 97.66 3.0 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 115.502 -0.772 . . . . 1.3700000000000001 108.939 174.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.551 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 41.9 t -144.12 138.64 28.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.321 0.582 . . . . 1.3100000000000001 112.1 -174.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.553 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 8.9 m-80 -67.66 -19.17 65.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.323 -0.853 . . . . 1.6699999999999999 111.391 174.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -61.69 -22.35 65.25 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.364 0.602 . . . . 1.8100000000000001 110.581 -178.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.642 ' CD2' ' HD2' ' A' ' 72' ' ' ARG . 13.5 m-85 -102.44 -5.91 23.55 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.943 -0.571 . . . . 3.8700000000000001 112.156 -174.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.553 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -80.92 -10.09 59.76 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.946 0.403 . . . . 2.1400000000000001 110.69 -176.85 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -75.79 -9.3 58.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.82 -0.627 . . . . 2.0299999999999998 109.817 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.451 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 2.7 mmmp? 68.55 18.6 8.88 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.169 -0.923 . . . . 3.8599999999999999 111.942 175.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.756 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 31.1 mmmt -69.5 89.79 0.52 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.347 -0.388 . . . . 2.4900000000000002 109.995 174.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -63.77 -59.67 4.26 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.742 0.306 . . . . 2.8900000000000001 110.476 -175.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.418 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.19 -31.18 71.4 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.188 -0.46 . . . . 1.6000000000000001 111.31 -177.327 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.756 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 27.0 t70 -73.91 -43.95 56.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.498 -0.319 . . . . 2.0800000000000001 110.788 -175.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.642 ' HD2' ' CD2' ' A' ' 64' ' ' PHE . 26.8 ptt180 -69.14 -31.93 70.94 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.297 -0.561 . . . . 3.4199999999999999 109.76 177.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -65.03 -49.72 69.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.152 -0.477 . . . . 1.3700000000000001 110.515 177.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.608 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 3.0 ptm180 -63.59 -40.93 98.21 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.52 -0.309 . . . . 2.1000000000000001 110.767 -179.243 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.26 -50.34 68.33 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.631 0.253 . . . . 2.1299999999999999 110.935 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.425 HG22 ' O ' ' A' ' 72' ' ' ARG . 49.2 t -56.58 -47.03 82.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.304 -0.407 . . . . 1.4099999999999999 110.94 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -66.56 -29.93 70.12 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 121.097 -0.241 . . . . 1.21 111.619 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 85.4 m -67.61 -43.91 79.31 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.865 0.364 . . . . 1.3200000000000001 111.307 -179.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.3 mp -81.29 -42.9 20.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 CA-C-O 121.331 0.586 . . . . 1.46 110.623 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.747 ' HA ' ' CB ' ' A' ' 83' ' ' GLU . 10.9 mp -73.27 -3.64 28.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.148 -0.478 . . . . 1.3799999999999999 111.129 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 45.6 tptt -51.8 -63.29 1.18 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.534 -0.543 . . . . 2.4199999999999999 109.534 169.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -75.16 -33.28 61.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.958 0.409 . . . . 2.9100000000000001 110.346 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.747 ' CB ' ' HA ' ' A' ' 80' ' ' LEU . 1.9 tp10 -54.02 -56.23 19.93 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.751 0.786 . . . . 1.6599999999999999 111.727 -176.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 57.5 mt -50.25 -30.95 12.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.243 -1.344 . . . . 1.27 112.882 177.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -54.76 -24.43 22.43 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.031 0.378 . . . . 0.96999999999999997 111.608 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -102.6 -0.02 32.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.553 -0.294 . . . . 1.02 111.75 -176.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 8.3 mt -126.13 139.88 50.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.683 0.278 . . . . 1.3100000000000001 110.383 -176.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 50.0 t60 -70.37 -42.19 72.11 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.804 -0.443 . . . . 2.29 109.804 175.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.416 ' O ' ' HB3' ' A' ' 54' ' ' SER . . . -157.54 111.6 2.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.159 -0.473 . . . . 1.3999999999999999 110.629 177.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -103.11 121.87 43.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.387 -0.369 . . . . 0.63 110.504 176.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.3 m -111.33 147.32 35.37 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.754 -0.657 . . . . 1.9399999999999999 109.494 177.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -135.82 142.17 44.81 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.013 0.435 . . . . 1.27 111.433 -178.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.502 ' HZ2' ' CG ' ' A' ' 56' ' ' ASP . 13.6 mptt -109.49 112.98 25.39 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.291 -0.633 . . . . 2.71 109.291 173.196 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.641 ' HA ' HG12 ' A' ' 59' ' ' ILE . 5.7 p -83.54 116.22 22.47 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.923 -0.581 . . . . 2.0 111.224 -175.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -143.62 166.95 23.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.29 0.566 . . . . 2.6099999999999999 111.372 176.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.435 HG22 ' HB3' ' A' ' 65' ' ' GLU . 22.0 p -113.87 163.32 19.07 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 115.544 -0.753 . . . . 1.27 110.901 -179.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.505 ' HG2' ' ND2' ' A' ' 62' ' ' ASN . 31.4 Cg_exo -60.95 -24.0 78.52 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.759 2.306 . . . . 1.0900000000000001 111.899 177.396 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -66.44 -49.35 67.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.844 -0.616 . . . . 2.6200000000000001 110.032 178.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.526 ' HA ' ' HD3' ' A' ' 102' ' ' LYS . 34.4 mt-10 -76.96 -30.44 56.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.071 -0.513 . . . . 2.6899999999999999 110.682 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 52.0 t80 -66.88 -41.45 87.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.435 -0.348 . . . . 1.6100000000000001 110.976 177.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -57.13 -38.14 73.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.027 0.442 . . . . 1.23 110.77 178.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.846 ' HA ' ' HE2' ' A' ' 106' ' ' LYS . 15.2 mtpp -58.07 -48.05 81.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.852 -0.613 . . . . 3.1499999999999999 110.558 178.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 53.2 mt -66.89 -41.95 86.35 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.85 -0.614 . . . . 1.5900000000000001 111.682 -175.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.474 ' HG3' ' N ' ' A' ' 105' ' ' SER . 7.0 pttp -83.09 -40.56 19.68 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.418 0.525 . . . . 2.3199999999999998 112.418 -172.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.487 ' HB2' ' HD3' ' A' ' 106' ' ' LYS . 17.5 m -83.04 -50.17 8.8 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 111.95 0.352 . . . . 2.21 111.95 -172.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.846 ' HE2' ' HA ' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -117.76 -53.17 2.41 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.427 0.528 . . . . 4.4400000000000004 112.427 -175.193 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 136.65 -41.94 1.36 Allowed Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.97 -0.633 . . . . 3.9199999999999999 111.581 -176.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 51.3 m . . . . . 0 C--O 1.246 0.886 0 CA-C-O 118.58 -0.724 . . . . 4.9800000000000004 110.211 178.767 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.1 ppp? . . . . . 0 N--CA 1.479 1.004 0 N-CA-C 110.171 -0.307 . . . . 36.359999999999999 110.171 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -112.6 -168.6 17.57 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.491 -0.861 . . . . 33.770000000000003 112.351 -178.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 42.3 m -84.86 -8.07 58.93 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.034 0.445 . . . . 32.670000000000002 110.525 178.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 24.4 m -77.85 114.04 16.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.979 -0.555 . . . . 30.75 110.198 177.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -97.12 165.69 11.94 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.07 -0.514 . . . . 28.739999999999998 111.303 -177.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 42.5 m80 -92.35 161.95 14.46 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.641 -0.709 . . . . 29.030000000000001 109.681 178.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 -121.57 97.84 5.69 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.012 0.434 . . . . 26.800000000000001 110.817 -177.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -86.86 109.75 19.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.061 -0.518 . . . . 24.5 110.25 175.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 58.3 m-70 -92.34 157.7 16.49 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.287 -0.415 . . . . 24.210000000000001 110.569 -177.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.7 t60 63.56 72.74 0.46 Allowed 'General case' 0 N--CA 1.464 0.225 0 O-C-N 123.716 0.635 . . . . 20.899999999999999 109.888 -175.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 35.8 t -154.11 111.26 3.4 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.666 -0.697 . . . . 20.109999999999999 109.586 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.7 p -94.3 89.0 5.75 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.975 0.417 . . . . 17.379999999999999 111.246 -176.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.585 ' HA2' ' HB3' ' A' ' 23' ' ' MET . . . 123.23 62.85 0.2 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.628 -0.796 . . . . 16.75 113.013 175.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 30.2 mtm180 -92.15 -44.07 9.01 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.511 -0.552 . . . . 19.629999999999999 109.511 177.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.405 ' HB2' ' CD1' ' A' ' 18' ' ' TYR . 1.4 pm0 -88.98 36.24 0.81 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.965 -0.562 . . . . 14.57 110.251 174.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.547 ' HA ' ' HA ' ' A' ' 22' ' ' HIS . 9.3 p30 -62.77 -8.96 7.75 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.728 -0.669 . . . . 16.100000000000001 111.59 -177.335 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -71.3 -23.18 61.9 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.98 0.419 . . . . 16.719999999999999 110.242 178.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.405 ' CD1' ' HB2' ' A' ' 15' ' ' GLU . 5.6 m-85 -78.14 132.26 37.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.767 -0.651 . . . . 15.609999999999999 109.748 177.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.4 p90 -72.91 -28.15 62.3 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.101 0.477 . . . . 11.970000000000001 109.893 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -92.36 3.46 55.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.916 -0.584 . . . . 10.890000000000001 110.842 -179.563 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -151.74 47.9 0.56 Allowed Glycine 0 N--CA 1.444 -0.77 0 C-N-CA 120.748 -0.739 . . . . 7.0 111.836 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 16' ' ' ASN . 6.0 t60 -69.57 -24.33 63.68 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.835 -0.802 . . . . 6.5999999999999996 108.835 178.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.585 ' HB3' ' HA2' ' A' ' 13' ' ' GLY . 6.8 tpt 71.9 71.67 0.16 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-N 114.435 -1.257 . . . . 4.7999999999999998 111.388 170.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.564 ' O ' HG21 ' A' ' 28' ' ' VAL . 21.3 t -76.48 135.65 39.36 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.39 -0.823 . . . . 2.2000000000000002 109.591 173.614 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.0 tp -57.06 -38.65 61.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 O-C-N 123.242 0.339 . . . . 1.8200000000000001 111.088 -176.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -61.68 -43.86 98.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.928 0.394 . . . . 1.99 110.279 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -71.27 -26.3 62.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.122 -0.49 . . . . 2.9300000000000002 111.01 -177.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.564 HG21 ' O ' ' A' ' 24' ' ' CYS . 91.2 t -61.76 -53.86 42.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.367 -0.379 . . . . 1.6299999999999999 110.19 176.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.48 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.8 mp -61.17 -43.76 97.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.784 -0.644 . . . . 1.3300000000000001 110.228 178.424 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -52.67 -51.81 58.56 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 116.028 -0.533 . . . . 2.2000000000000002 111.769 178.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -69.69 -30.93 68.7 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.283 0.563 . . . . 1.6699999999999999 110.684 -177.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 31.1 tttm -68.57 -54.48 16.35 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.378 -0.828 . . . . 2.5299999999999998 111.065 -176.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 3.9 pp -71.92 -27.04 62.55 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 120.757 -0.377 . . . . 1.24 111.048 176.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.457 ' N ' HD12 ' A' ' 33' ' ' LEU . 44.3 t -61.93 -44.04 97.6 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-O 120.805 0.336 . . . . 1.6599999999999999 110.226 176.301 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.2 m -64.22 -27.37 69.01 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.327 -0.397 . . . . 0.79000000000000004 110.965 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.86 -54.43 5.6 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.093 0.405 . . . . 1.24 112.093 -177.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.0 mt -97.07 -35.59 10.77 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.867 0.365 . . . . 1.49 111.725 -174.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.492 ' HA ' ' HD3' ' A' ' 38' ' ' LYS . 31.8 mmtt 58.15 87.29 0.14 Allowed Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.364 -0.835 . . . . 3.8500000000000001 112.862 -177.631 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.777 ' HB3' HG12 ' A' ' 59' ' ' ILE . 73.7 Cg_endo -82.91 137.62 8.77 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 122.62 2.213 . . . . 0.67000000000000004 111.34 171.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 33.4 p -77.54 -23.89 50.01 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.42 0.629 . . . . 1.3700000000000001 109.695 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.605 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 83.9 t80 -136.3 124.05 22.5 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.123 -0.944 . . . . 0.83999999999999997 109.176 172.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.41 HD12 ' O ' ' A' ' 58' ' ' VAL . 56.7 tp -134.9 113.86 11.97 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.432 -0.349 . . . . 2.1899999999999999 110.337 -177.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -120.37 124.85 46.54 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.385 -0.371 . . . . 2.23 110.974 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 67.1 mt -86.4 122.16 29.97 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.172 0.511 . . . . 2.23 110.787 175.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 67.6 t -106.96 111.09 34.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.479 -0.782 . . . . 1.72 109.05 175.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -69.28 102.11 1.65 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.994 -0.548 . . . . 1.8300000000000001 109.977 -177.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 36.2 mmtm -76.66 167.0 22.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.046 -0.525 . . . . 3.2400000000000002 111.05 -177.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.3 p -63.05 130.21 43.68 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.935 -0.575 . . . . 3.3799999999999999 110.386 176.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.7 p -62.2 -67.55 0.41 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.091 -0.504 . . . . 5.1600000000000001 111.466 -178.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 68.31 -82.32 0.19 Allowed Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 121.031 -0.604 . . . . 3.3300000000000001 112.51 179.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 10.8 p -94.74 -19.1 20.66 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.83 0.347 . . . . 4.6299999999999999 111.002 -179.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 168.29 -176.09 42.82 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.81 -0.709 . . . . 2.7599999999999998 111.996 179.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.429 ' O ' ' HB3' ' A' ' 88' ' ' HIS . 19.9 m -58.65 115.34 2.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.865 0.364 . . . . 3.98 111.299 -179.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.3 m -127.12 120.79 29.7 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.867 -0.606 . . . . 2.04 110.993 -176.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -111.43 138.69 47.61 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.091 -0.504 . . . . 1.3 110.384 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -116.54 123.02 46.38 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.24 -0.652 . . . . 1.3500000000000001 109.24 176.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.98 115.74 30.74 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.863 0.363 . . . . 1.23 110.899 -176.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.754 HG21 ' HE2' ' A' ' 93' ' ' LYS . 38.3 t -81.07 110.95 17.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 108.621 -0.881 . . . . 1.1799999999999999 108.621 173.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.777 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -111.53 107.7 23.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 CA-C-O 121.679 0.752 . . . . 1.9399999999999999 110.485 -174.011 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.613 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 58.0 t -104.58 106.64 20.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 CA-C-N 114.94 -1.027 . . . . 1.3700000000000001 108.464 174.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.655 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 32.7 t -142.84 147.43 35.41 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.755 0.65 . . . . 1.3100000000000001 112.755 -170.243 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.471 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 0.6 OUTLIER -64.09 -22.19 66.83 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 114.988 -1.006 . . . . 1.6699999999999999 110.829 173.258 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -63.35 -35.62 81.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.188 0.518 . . . . 1.8100000000000001 110.417 -177.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.409 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 27.2 t80 -100.49 12.04 38.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.318 0.58 . . . . 3.8700000000000001 110.118 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.471 ' HB3' ' O ' ' A' ' 62' ' ' ASN . 2.2 tp10 -81.31 -28.55 34.55 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 108.087 -1.079 . . . . 2.1400000000000001 108.087 176.232 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.596 ' OD2' ' HG3' ' A' ' 68' ' ' LYS . 21.0 t70 -57.32 -41.13 79.33 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 108.293 -1.003 . . . . 2.0299999999999998 108.293 166.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.0 ttpm? 75.59 25.02 1.25 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 114.476 -1.238 . . . . 3.8599999999999999 113.161 161.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.596 ' HG3' ' OD2' ' A' ' 66' ' ' ASP . 36.7 mtmm -74.76 122.53 23.44 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 121.97 -0.456 . . . . 2.4900000000000002 109.959 169.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.5 pp -74.0 -32.18 63.28 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.772 -0.371 . . . . 2.8900000000000001 110.953 -175.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.482 HD11 ' HB3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -67.72 -30.81 70.4 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.038 0.447 . . . . 1.6000000000000001 110.417 177.32 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.443 ' HB2' ' HE2' ' A' ' 68' ' ' LYS . 36.0 t70 -72.62 -36.91 68.16 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.155 0.502 . . . . 2.0800000000000001 109.658 179.49 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.409 ' HB2' ' CE1' ' A' ' 64' ' ' PHE . 48.3 ttt-85 -57.77 -47.25 83.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.496 -0.775 . . . . 3.4199999999999999 109.563 172.309 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -57.22 -54.46 46.5 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.143 -0.935 . . . . 1.3700000000000001 111.28 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.426 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 13.2 ptm180 -70.7 -46.42 63.15 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.285 0.476 . . . . 2.1000000000000001 112.285 -172.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 75' ' ' LEU . 27.3 mt -63.08 -45.97 89.63 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 111.759 0.281 . . . . 2.1299999999999999 111.759 -176.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.539 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 58.7 t -58.05 -48.25 84.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.57 -0.286 . . . . 1.4099999999999999 110.487 179.002 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -66.58 -31.7 72.57 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.687 -0.405 . . . . 1.21 111.564 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 99.2 m -61.71 -61.41 2.53 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.655 0.242 . . . . 1.3200000000000001 111.655 -178.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.5 mp -75.95 -43.8 38.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-O 121.071 0.463 . . . . 1.46 110.833 -176.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.777 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.4 mp -77.65 -7.55 56.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.903 -0.59 . . . . 1.3799999999999999 112.338 -171.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -50.13 -62.55 1.51 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.277 0.56 . . . . 2.4199999999999999 109.9 171.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -75.15 -33.52 61.53 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.448 -0.796 . . . . 2.9100000000000001 110.708 177.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.777 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.3 tp10 -56.29 -53.53 56.21 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.477 0.656 . . . . 1.6599999999999999 112.026 -176.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.663 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 66.3 mt -50.72 -30.44 13.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.711 -1.131 . . . . 1.27 112.505 179.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -53.5 -27.36 25.07 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.046 0.451 . . . . 0.96999999999999997 111.038 -178.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -87.0 -6.78 58.64 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.804 -0.634 . . . . 1.02 111.701 -175.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.469 HD12 ' HB2' ' A' ' 90' ' ' PHE . 3.2 mt -125.52 160.36 31.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 109.969 -0.382 . . . . 1.3100000000000001 109.969 -176.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.429 ' HB3' ' O ' ' A' ' 53' ' ' THR . 10.5 t60 -79.36 -54.82 5.56 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.421 -0.585 . . . . 2.29 109.421 174.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -145.26 115.59 7.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.828 -0.624 . . . . 1.3999999999999999 110.176 177.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . 0.469 ' HB2' HD12 ' A' ' 87' ' ' ILE . 86.2 t80 -108.4 129.19 55.26 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.161 0.505 . . . . 0.63 110.605 177.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 38.2 t -115.02 146.76 40.93 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.267 -0.879 . . . . 1.9399999999999999 109.25 177.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -129.3 130.69 46.48 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.929 0.395 . . . . 1.27 110.417 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.754 ' HE2' HG21 ' A' ' 58' ' ' VAL . 2.3 ttmm -113.7 109.01 17.9 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.864 -0.791 . . . . 2.71 108.864 176.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.504 ' HA ' HG21 ' A' ' 59' ' ' ILE . 13.2 p -92.16 140.9 29.17 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.934 0.397 . . . . 2.0 111.358 -172.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.613 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 8.7 t60 -153.65 154.43 34.16 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.939 -0.573 . . . . 2.6099999999999999 109.712 177.414 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.417 ' CG2' ' HA ' ' A' ' 65' ' ' GLU . 1.3 p -96.6 148.79 34.97 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 121.042 0.449 . . . . 1.27 112.093 -177.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -67.87 -35.34 21.31 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 123.255 2.637 . . . . 1.0900000000000001 113.075 -176.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.4 -48.22 82.46 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.112 0.482 . . . . 2.6200000000000001 110.225 179.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -66.24 -33.78 76.52 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.623 -0.717 . . . . 2.6899999999999999 111.012 177.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 49.7 t80 -69.83 -33.99 73.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.469 -0.332 . . . . 1.6100000000000001 111.4 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -58.08 -35.15 70.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.94 0.4 . . . . 1.23 111.087 -178.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.701 ' HE2' ' N ' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -74.91 -29.35 60.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.907 0.384 . . . . 3.1499999999999999 110.378 178.528 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.752 ' HA ' ' HA2' ' A' ' 107' ' ' GLY . 89.7 mt -67.84 -47.09 69.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.941 -0.572 . . . . 1.5900000000000001 110.67 179.19 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.88 -15.78 61.59 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.205 -0.452 . . . . 2.3199999999999998 111.147 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 28.4 t -80.95 -39.62 25.81 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.766 -0.457 . . . . 2.21 109.766 176.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.28 -41.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.821 -0.627 . . . . 4.4400000000000004 110.74 179.103 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.752 ' HA2' ' HA ' ' A' ' 103' ' ' LEU . . . 117.18 27.17 2.75 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.419 -0.809 . . . . 3.9199999999999999 111.684 -179.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.5 t . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.27 -0.871 . . . . 4.9800000000000004 109.455 -178.311 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.1 ptt? . . . . . 0 N--CA 1.479 0.988 0 N-CA-C 109.919 -0.4 . . . . 36.359999999999999 109.919 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 110.87 25.49 5.1 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.362 -0.923 . . . . 33.770000000000003 112.532 177.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.3 m -101.6 -4.28 26.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.23 0.538 . . . . 32.670000000000002 110.01 178.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.2 m -110.32 147.16 34.44 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.4 -0.818 . . . . 30.75 109.974 -177.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 4.8 p-80 -93.05 87.14 5.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.517 0.675 . . . . 28.739999999999998 111.442 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 85.6 m-70 -109.6 13.31 23.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.877 -0.602 . . . . 29.030000000000001 110.275 175.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -162.45 143.58 10.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.168 -0.469 . . . . 26.800000000000001 110.343 -178.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 50.6 t-80 -92.95 147.62 22.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.143 -0.48 . . . . 24.5 109.756 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 40.2 m-70 -82.78 -174.42 5.23 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.927 0.394 . . . . 24.210000000000001 111.014 178.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.9 m-70 -97.04 129.43 44.48 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.081 -0.509 . . . . 20.899999999999999 111.523 -176.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.43 ' HB2' ' H ' ' A' ' 12' ' ' SER . 3.5 p -88.22 -146.53 0.15 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.564 -0.744 . . . . 20.109999999999999 110.194 175.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.43 ' H ' ' HB2' ' A' ' 11' ' ' SER . 11.6 t -61.53 129.2 40.0 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.854 -0.424 . . . . 17.379999999999999 109.854 177.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 128.85 -0.51 6.2 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 121.16 -0.543 . . . . 16.75 111.75 -176.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.1 ptt180 -93.89 -26.6 16.81 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.365 0.603 . . . . 19.629999999999999 109.843 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -87.65 16.87 5.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.412 -0.813 . . . . 14.57 111.198 -176.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -69.15 -9.06 50.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.063 0.459 . . . . 16.100000000000001 110.407 178.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 87.9 mt -68.94 -20.19 64.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.858 -0.61 . . . . 16.719999999999999 110.47 177.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 -104.73 142.92 33.85 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.982 -0.554 . . . . 15.609999999999999 109.748 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 48.2 p90 -59.56 -39.05 82.78 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.703 0.287 . . . . 11.970000000000001 111.441 -176.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -89.0 8.08 31.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.85 0.357 . . . . 10.890000000000001 111.273 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -94.59 -9.39 58.87 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.78 -0.724 . . . . 7.0 112.19 -177.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -148.58 113.53 5.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.22 0.534 . . . . 6.5999999999999996 110.112 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 75.8 mtm -130.46 145.22 51.8 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.19 -0.459 . . . . 4.7999999999999998 110.06 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 32.3 m -65.83 146.11 55.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.033 -0.531 . . . . 2.2000000000000002 110.74 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.3 tp -57.2 -34.04 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-O 121.178 0.513 . . . . 1.8200000000000001 110.925 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -65.52 -38.89 91.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.104 -0.498 . . . . 1.99 110.922 178.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.696 ' HA ' ' HE3' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -68.4 -46.57 69.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.093 -0.503 . . . . 2.9300000000000002 111.193 -175.615 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.51 ' O ' ' HG2' ' A' ' 32' ' ' LYS . 5.3 p -64.87 -46.04 93.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 C-N-CA 120.833 -0.347 . . . . 1.6299999999999999 111.163 -177.445 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.454 HD13 HG12 ' A' ' 28' ' ' VAL . 1.7 mp -60.71 -47.62 92.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-O 121.033 0.444 . . . . 1.3300000000000001 110.721 178.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.64 -42.02 91.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.326 -0.397 . . . . 2.2000000000000002 110.77 -178.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -68.04 -35.4 78.2 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.167 -0.47 . . . . 1.6699999999999999 111.423 -175.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' A' ' 28' ' ' VAL . 74.1 mmtt -65.06 -55.61 17.84 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.935 0.398 . . . . 2.5299999999999998 111.067 -178.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.488 HD11 ' N ' ' A' ' 34' ' ' SER . 3.3 pp -71.81 -28.9 63.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.126 -0.488 . . . . 1.24 112.135 -174.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.488 ' N ' HD11 ' A' ' 33' ' ' LEU . 69.7 m -69.23 -43.05 74.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.769 0.319 . . . . 1.6599999999999999 110.97 179.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.7 m -71.3 -27.45 63.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.1 0.476 . . . . 0.79000000000000004 111.076 -178.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.65 -54.94 4.0 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.032 0.382 . . . . 1.24 112.032 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.1 mt -81.85 -32.04 31.33 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.848 0.314 . . . . 1.49 111.848 -173.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm 65.16 74.77 0.38 Allowed Pre-proline 0 N--CA 1.468 0.456 0 O-C-N 123.595 0.559 . . . . 3.8500000000000001 110.99 -175.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.675 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 63.0 Cg_endo -88.66 134.76 2.83 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 122.289 1.993 . . . . 0.67000000000000004 112.374 176.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 30.4 p -68.86 -30.56 69.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.276 0.56 . . . . 1.3700000000000001 109.64 175.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.667 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 86.3 t80 -141.91 134.27 27.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.325 -0.852 . . . . 0.83999999999999997 109.262 174.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -142.24 126.16 17.19 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.547 -0.538 . . . . 2.1899999999999999 109.547 -178.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -137.48 127.79 26.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.889 0.375 . . . . 2.23 110.934 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.41 ' N ' HD22 ' A' ' 44' ' ' LEU . 2.5 mm? -90.61 115.76 27.98 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.368 -0.604 . . . . 2.23 109.368 177.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 52.5 t -109.08 118.25 56.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.901 0.382 . . . . 1.72 110.769 -178.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -91.19 123.64 34.79 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.108 -0.701 . . . . 1.8300000000000001 109.108 173.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 60.6 tttp -136.38 89.46 2.47 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.791 0.329 . . . . 3.2400000000000002 110.857 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 44.6 m 54.45 62.46 2.55 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.454 -0.794 . . . . 3.3799999999999999 112.164 174.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 3.5 p -75.63 111.22 10.72 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.132 -0.485 . . . . 5.1600000000000001 109.905 176.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -78.42 -45.97 9.34 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.962 -0.637 . . . . 3.3300000000000001 113.188 -174.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 45.8 m -108.18 102.32 11.48 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.786 0.327 . . . . 4.6299999999999999 111.4 -176.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 70.13 -94.6 0.46 Allowed Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.941 -0.572 . . . . 2.7599999999999998 112.342 177.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.8 t -152.66 135.83 15.72 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.219 0.533 . . . . 3.98 110.488 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 62.3 m -146.52 119.62 8.84 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.315 -0.857 . . . . 2.04 109.109 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -111.39 137.6 48.96 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.597 -0.274 . . . . 1.3 110.82 -176.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -102.18 110.23 22.13 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.754 -1.202 . . . . 1.3500000000000001 107.754 168.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.77 117.53 34.25 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 120.899 0.38 . . . . 1.23 111.268 -171.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.7 t -73.39 111.27 7.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 109.026 -0.731 . . . . 1.1799999999999999 109.026 176.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -106.87 107.81 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 CA-C-O 121.774 0.797 . . . . 1.9399999999999999 109.571 -178.313 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.667 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 58.7 t -108.21 103.97 16.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.108 -0.951 . . . . 1.3700000000000001 108.971 177.087 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.675 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 29.0 t -145.26 153.27 41.13 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.986 0.422 . . . . 1.3100000000000001 111.291 -175.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.733 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 22.9 m120 -67.44 -19.21 65.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.486 -0.779 . . . . 1.6699999999999999 110.477 175.083 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -63.65 -18.97 64.5 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.236 0.541 . . . . 1.8100000000000001 110.384 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.609 ' HD2' HG23 ' A' ' 96' ' ' THR . 62.9 t80 -93.46 -19.8 20.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 3.8700000000000001 111.561 -178.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.733 ' HG2' ' O ' ' A' ' 62' ' ' ASN . 11.9 pt-20 -71.23 -20.06 62.29 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.627 -0.429 . . . . 2.1400000000000001 110.474 -176.318 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.582 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . 17.2 m-20 -69.15 -20.48 64.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.029 -0.532 . . . . 2.0299999999999998 110.581 175.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.11 19.74 11.89 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.453 -0.794 . . . . 3.8599999999999999 110.777 177.222 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.582 ' HG2' ' HB3' ' A' ' 66' ' ' ASP . 31.3 mmmt -79.54 102.63 8.95 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.907 -0.588 . . . . 2.4900000000000002 110.323 -178.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.403 HD12 ' N ' ' A' ' 70' ' ' LEU . 3.7 pp -67.55 -44.22 78.8 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.324 -0.398 . . . . 2.8900000000000001 110.767 -177.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.41 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.73 -31.24 71.04 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.49 -0.323 . . . . 1.6000000000000001 111.254 -178.972 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.679 ' HA ' ' HD2' ' A' ' 74' ' ' ARG . 4.8 m-20 -73.55 -44.77 56.68 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 121.094 -0.242 . . . . 2.0800000000000001 111.345 -178.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 18.3 ptt180 -67.89 -31.93 72.07 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.909 -0.716 . . . . 3.4199999999999999 109.82 176.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -64.03 -50.97 66.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.071 -0.513 . . . . 1.3700000000000001 110.521 176.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.679 ' HD2' ' HA ' ' A' ' 71' ' ' ASP . 5.0 ptm180 -63.57 -39.55 94.68 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.399 -0.364 . . . . 2.1000000000000001 110.836 -177.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -66.48 -51.84 52.48 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.723 0.297 . . . . 2.1299999999999999 111.046 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.69 HG11 HD21 ' A' ' 80' ' ' LEU . 45.6 t -57.74 -45.69 86.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.065 -0.516 . . . . 1.4099999999999999 110.978 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.537 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 12.7 m120 -62.73 -42.01 99.45 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.475 -0.49 . . . . 1.21 111.262 -178.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.444 ' HB ' HD13 ' A' ' 79' ' ' ILE . 89.3 m -58.76 -54.67 44.44 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.113 0.412 . . . . 1.3200000000000001 112.113 -175.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.444 HD13 ' HB ' ' A' ' 78' ' ' THR . 4.3 mp -88.01 -48.51 15.04 Favored 'Isoleucine or valine' 0 C--O 1.242 0.663 0 CA-C-O 121.643 0.735 . . . . 1.46 111.016 -175.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.776 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 7.7 mp -73.31 -4.37 32.82 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.654 -0.703 . . . . 1.3799999999999999 111.668 -173.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.537 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 17.6 tppt? -55.72 -60.0 4.07 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.358 -0.608 . . . . 2.4199999999999999 109.358 168.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.434 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 6.9 mm-40 -67.72 -32.94 73.91 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.65 -0.705 . . . . 2.9100000000000001 110.261 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.635 ' CB ' ' HA ' ' A' ' 80' ' ' LEU . 2.6 tp10 -54.59 -55.35 30.35 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.815 -0.63 . . . . 1.6599999999999999 111.054 176.187 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.776 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 56.3 mt -51.03 -30.58 15.88 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.273 -0.876 . . . . 1.27 112.46 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.434 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 23.1 mm-40 -54.41 -25.52 25.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.64 0.257 . . . . 0.96999999999999997 111.436 -176.471 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -106.63 8.28 31.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.716 0.293 . . . . 1.02 111.326 -177.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 11.2 mt -129.35 155.81 41.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 109.635 -0.506 . . . . 1.3100000000000001 109.635 -178.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -86.9 -61.11 1.8 Allowed 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.414 -0.514 . . . . 2.29 109.778 175.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -137.85 95.15 2.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.056 0.455 . . . . 1.3999999999999999 110.99 178.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -84.68 119.63 25.47 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.018 -0.537 . . . . 0.63 110.204 176.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 38.0 m -112.42 157.13 21.43 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.556 -0.535 . . . . 1.9399999999999999 109.556 177.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -134.97 137.78 43.38 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.96 0.409 . . . . 1.27 110.655 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.686 ' HZ3' ' HB2' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -103.12 109.0 20.41 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.338 -0.986 . . . . 2.71 108.338 176.175 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.7 m -88.08 127.84 35.41 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 111.837 0.31 . . . . 2.0 111.837 -169.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.612 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 73.0 m-70 -148.42 160.95 42.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.108 0.48 . . . . 2.6099999999999999 110.668 174.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.609 HG23 ' HD2' ' A' ' 64' ' ' PHE . 22.6 p -108.44 159.42 30.87 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.771 -0.65 . . . . 1.27 110.697 176.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -59.26 -26.35 81.5 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.594 2.196 . . . . 1.0900000000000001 111.834 176.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -62.9 -49.78 73.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.012 -0.54 . . . . 2.6200000000000001 109.961 176.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.469 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 30.5 mt-10 -60.4 -47.71 84.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.873 -0.603 . . . . 2.6899999999999999 110.313 176.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.549 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 51.4 t80 -60.43 -39.16 86.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.617 -0.72 . . . . 1.6100000000000001 111.087 -177.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.526 ' HA ' ' HE2' ' A' ' 104' ' ' LYS . 18.8 t70 -60.78 -37.68 82.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.954 0.407 . . . . 1.23 110.772 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.544 ' HE2' ' N ' ' A' ' 102' ' ' LYS . 0.3 OUTLIER -71.92 -32.35 67.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.138 -0.483 . . . . 3.1499999999999999 110.362 178.6 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 85.7 mt -64.43 -41.6 96.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.071 -0.513 . . . . 1.5900000000000001 110.83 177.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.549 ' HG3' ' O ' ' A' ' 100' ' ' TYR . 12.2 mtmt -63.98 -43.13 96.64 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.501 0.667 . . . . 2.3199999999999998 109.704 176.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 48.4 m -69.54 -71.3 0.23 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.81 -1.086 . . . . 2.21 111.722 -173.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' A' ' 102' ' ' LYS . 5.8 pttt -99.56 -36.55 9.49 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.739 0.305 . . . . 4.4400000000000004 111.348 -176.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 109.02 12.92 19.35 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.68 -0.771 . . . . 3.9199999999999999 112.011 -178.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' SER . . . . . 0.444 ' OXT' ' HB3' ' A' ' 102' ' ' LYS . 34.1 m . . . . . 0 C--O 1.249 1.075 0 N-CA-C 108.969 -0.752 . . . . 4.9800000000000004 108.969 179.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.1 mtm . . . . . 0 N--CA 1.48 1.05 0 N-CA-C 109.389 -0.597 . . . . 36.359999999999999 109.389 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -101.94 110.58 3.85 Favored Glycine 0 N--CA 1.441 -0.971 0 N-CA-C 110.573 -1.011 . . . . 33.770000000000003 110.573 171.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 56.1 m -52.59 110.53 0.52 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.984 0.421 . . . . 32.670000000000002 110.847 -177.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.8 m -78.93 116.04 19.0 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.887 -0.597 . . . . 30.75 110.344 -177.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -106.48 174.05 6.06 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.823 -0.626 . . . . 28.739999999999998 110.459 -177.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 14.3 m170 -100.96 144.95 29.28 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 110.223 -0.288 . . . . 29.030000000000001 110.223 -174.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.0 m170 -95.39 151.9 18.87 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.557 -0.534 . . . . 26.800000000000001 109.557 175.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 27.6 t60 -71.94 124.97 26.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.002 0.43 . . . . 24.5 110.779 -173.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -111.63 172.22 7.02 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.914 -0.584 . . . . 24.210000000000001 109.662 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 43.5 p-80 -90.7 119.8 31.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.271 0.557 . . . . 20.899999999999999 110.16 177.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 25.1 m -92.36 161.37 14.7 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.756 -0.656 . . . . 20.109999999999999 110.022 178.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.7 m -87.1 9.09 20.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.484 0.659 . . . . 17.379999999999999 111.146 -176.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -85.62 12.23 59.68 Favored Glycine 0 C--O 1.224 -0.495 0 CA-C-N 115.366 -0.834 . . . . 16.75 111.335 177.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.484 ' HG3' ' HG2' ' A' ' 15' ' ' GLU . 4.4 ptm85 -72.77 -36.19 67.59 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 122.943 0.497 . . . . 19.629999999999999 111.506 -179.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.492 ' HB2' ' CE2' ' A' ' 18' ' ' TYR . 5.9 pt-20 -119.48 61.55 0.82 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.78 0.8 . . . . 14.57 111.183 -174.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -88.92 3.8 50.16 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.783 -1.099 . . . . 16.100000000000001 110.338 177.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.7 mt -75.11 -32.24 61.34 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.741 -0.663 . . . . 16.719999999999999 111.872 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.642 ' HB3' ' HA3' ' A' ' 21' ' ' GLY . 8.3 m-85 -80.94 88.27 5.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.72 0.295 . . . . 15.609999999999999 110.469 -176.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -83.51 -12.99 55.57 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.978 0.418 . . . . 11.970000000000001 110.774 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -131.15 12.78 5.14 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.551 0.691 . . . . 10.890000000000001 109.591 174.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.642 ' HA3' ' HB3' ' A' ' 18' ' ' TYR . . . -93.59 -46.77 3.13 Favored Glycine 0 N--CA 1.449 -0.499 0 CA-C-N 115.419 -0.809 . . . . 7.0 113.942 -171.156 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -129.47 17.86 5.88 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 117.37 0.585 . . . . 6.5999999999999996 111.531 -174.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 66.4 mtm -117.9 157.15 27.2 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.742 -0.466 . . . . 4.7999999999999998 109.742 177.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 84.5 m -60.63 108.13 0.79 Allowed 'General case' 0 C--N 1.329 -0.31 0 O-C-N 123.216 0.322 . . . . 2.2000000000000002 110.884 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 10.1 tp -59.48 -30.06 43.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.931 -0.577 . . . . 1.8200000000000001 110.948 -178.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -60.31 -43.41 96.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.198 -0.455 . . . . 1.99 110.437 177.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.547 ' HE3' ' HB2' ' A' ' 31' ' ' ASP . 38.8 tptt -67.5 -36.92 82.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.956 -0.565 . . . . 2.9300000000000002 110.843 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 61.3 t -57.91 -52.24 60.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.061 0.457 . . . . 1.6299999999999999 110.589 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.442 HG13 ' HG3' ' A' ' 83' ' ' GLU . 1.8 mp -64.35 -47.34 90.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.808 -0.633 . . . . 1.3300000000000001 110.542 178.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -54.81 -52.05 63.9 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 116.218 -0.446 . . . . 2.2000000000000002 110.892 -179.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.547 ' HB2' ' HE3' ' A' ' 27' ' ' LYS . 10.6 t70 -66.07 -31.09 71.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.245 -0.434 . . . . 1.6699999999999999 110.971 -174.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 52.3 tptt -70.15 -55.63 8.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.517 -0.31 . . . . 2.5299999999999998 111.258 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.508 HD13 ' N ' ' A' ' 34' ' ' SER . 3.9 pp -71.47 -26.32 62.66 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.894 -0.322 . . . . 1.24 111.168 -178.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.508 ' N ' HD13 ' A' ' 33' ' ' LEU . 9.5 t -66.77 -42.24 86.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.94 0.4 . . . . 1.6599999999999999 110.132 178.225 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 26.3 m -71.59 -27.07 62.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.12 0.486 . . . . 0.79000000000000004 111.027 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.79 -52.2 7.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.121 -0.49 . . . . 1.24 111.615 -178.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.2 mt -83.65 -42.09 17.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.504 -0.316 . . . . 1.49 111.23 -176.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 56.92 83.94 0.22 Allowed Pre-proline 0 N--CA 1.464 0.227 0 CA-C-O 121.694 0.759 . . . . 3.8500000000000001 111.436 -175.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.71 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 74.2 Cg_endo -92.24 151.47 3.11 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 123.271 2.647 . . . . 0.67000000000000004 112.991 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.7 p -76.95 -27.24 54.75 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.419 0.628 . . . . 1.3700000000000001 109.958 175.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.772 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 88.6 t80 -141.73 132.52 25.74 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.336 -0.847 . . . . 0.83999999999999997 109.082 173.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.519 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 60.0 tp -142.38 121.42 12.89 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 110.317 -0.253 . . . . 2.1899999999999999 110.317 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -124.4 115.83 21.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.065 0.46 . . . . 2.23 110.78 178.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -85.94 115.5 23.6 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.135 -0.691 . . . . 2.23 109.135 174.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.568 HG13 ' HG3' ' A' ' 47' ' ' LYS . 19.8 t -106.13 113.56 43.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 120.913 0.387 . . . . 1.72 110.711 -177.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -72.66 106.08 4.53 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.937 -0.574 . . . . 1.8300000000000001 110.042 175.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.568 ' HG3' HG13 ' A' ' 45' ' ' VAL . 56.4 mtmt -133.05 98.12 4.19 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.816 -0.629 . . . . 3.2400000000000002 109.706 177.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 34.0 t -64.51 110.71 2.4 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.303 0.573 . . . . 3.3799999999999999 110.541 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 22.9 t -79.21 -11.18 59.96 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.47 -0.787 . . . . 5.1600000000000001 110.182 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 156.34 -58.25 0.37 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 121.033 -0.603 . . . . 3.3300000000000001 112.53 179.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 6.4 p -71.46 -32.32 68.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.87 0.367 . . . . 4.6299999999999999 111.575 -177.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 114.85 -44.52 1.47 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.827 -0.701 . . . . 2.7599999999999998 111.734 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.9 p -82.45 64.2 6.98 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.547 0.689 . . . . 3.98 110.903 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.404 ' HA ' ' O ' ' A' ' 89' ' ' ALA . 25.0 p -136.44 117.3 14.14 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.422 -0.808 . . . . 2.04 110.384 -179.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -124.96 137.69 54.25 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.176 -0.466 . . . . 1.3 110.442 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.421 ' CG ' ' HZ2' ' A' ' 93' ' ' LYS . 23.1 t0 -114.68 122.04 45.23 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.831 -0.622 . . . . 1.3500000000000001 109.519 178.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -107.11 115.99 31.14 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.911 0.386 . . . . 1.23 111.861 -174.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.2 t -83.25 111.76 19.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.19 -0.67 . . . . 1.1799999999999999 109.19 173.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -111.97 115.09 48.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.646 0.736 . . . . 1.9399999999999999 110.594 -174.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.772 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 74.7 t -114.49 106.83 21.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.013 -0.994 . . . . 1.3700000000000001 109.411 176.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.71 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 42.5 t -146.7 153.01 39.76 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.87 0.692 . . . . 1.3100000000000001 112.87 -173.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.442 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 12.4 m120 -67.31 -22.0 65.64 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.109 -0.95 . . . . 1.6699999999999999 110.518 172.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -65.57 -24.04 66.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.293 0.568 . . . . 1.8100000000000001 110.13 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.444 ' CE1' ' HD3' ' A' ' 72' ' ' ARG . 71.0 t80 -103.06 -2.93 26.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.683 -0.69 . . . . 3.8700000000000001 110.449 178.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.442 ' HB3' ' HA ' ' A' ' 62' ' ' ASN . 0.9 OUTLIER -72.49 -33.18 66.77 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.584 -0.525 . . . . 2.1400000000000001 109.584 -175.157 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.641 ' OD2' ' HD3' ' A' ' 68' ' ' LYS . 3.1 t70 -63.6 -14.41 51.29 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.716 -0.476 . . . . 2.0299999999999998 109.716 176.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 30.6 mtmm 63.25 50.08 3.09 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.159 -0.928 . . . . 3.8599999999999999 111.458 174.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.641 ' HD3' ' OD2' ' A' ' 66' ' ' ASP . 30.5 mmmt -89.37 96.09 10.56 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.091 -0.959 . . . . 2.4900000000000002 110.527 179.256 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 46.9 tp -55.69 -64.31 0.89 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.018 -0.537 . . . . 2.8900000000000001 111.741 -178.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.92 -31.01 71.69 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.211 -0.449 . . . . 1.6000000000000001 111.46 -175.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.554 ' HB2' ' HB3' ' A' ' 68' ' ' LYS . 23.3 m-20 -73.59 -36.42 65.54 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.844 0.313 . . . . 2.0800000000000001 111.844 -176.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.444 ' HD3' ' CE1' ' A' ' 64' ' ' PHE . 25.0 ptt85 -69.9 -32.93 71.52 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 119.891 -0.724 . . . . 3.4199999999999999 109.393 175.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -64.73 -49.36 71.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.693 -0.685 . . . . 1.3700000000000001 110.231 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.517 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 4.2 ptm180 -69.57 -40.51 76.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.864 -0.607 . . . . 2.1000000000000001 111.508 -178.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 35.9 tp -64.96 -47.2 78.46 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.732 0.301 . . . . 2.1299999999999999 110.743 -177.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.614 HG11 HD23 ' A' ' 80' ' ' LEU . 37.2 t -57.31 -48.32 82.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.98 -0.554 . . . . 1.4099999999999999 110.701 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -61.19 -33.58 73.69 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.652 -0.249 . . . . 1.21 111.533 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 95.9 m -63.62 -56.16 17.97 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 111.804 0.298 . . . . 1.3200000000000001 111.804 -178.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.2 mp -76.78 -46.84 29.62 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 CA-C-O 121.317 0.58 . . . . 1.46 110.744 -178.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.932 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 9.1 mp -73.16 -3.6 27.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.879 -0.6 . . . . 1.3799999999999999 111.589 -175.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 48.0 tptt -50.64 -63.69 1.04 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.635 -0.506 . . . . 2.4199999999999999 109.635 170.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -75.07 -36.49 61.77 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.417 -0.356 . . . . 2.9100000000000001 110.622 177.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.932 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 34.4 tt0 -57.09 -45.32 83.45 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.349 -0.387 . . . . 1.6599999999999999 111.895 -176.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 42.4 mt -56.81 -30.78 64.05 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.471 0.545 . . . . 1.27 112.471 -177.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -54.93 -24.57 24.3 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 120.857 0.36 . . . . 0.96999999999999997 111.5 -174.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -91.44 -4.78 55.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.247 -0.433 . . . . 1.02 111.129 -175.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.415 HD12 HG12 ' A' ' 29' ' ' ILE . 6.0 mt -124.25 137.65 56.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.444 -0.344 . . . . 1.3100000000000001 110.187 -176.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -75.96 -47.72 23.95 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.626 -0.509 . . . . 2.29 109.626 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.404 ' O ' ' HA ' ' A' ' 54' ' ' SER . . . -141.23 96.65 3.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.987 0.423 . . . . 1.3999999999999999 111.217 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -92.79 144.61 25.12 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.167 -0.469 . . . . 0.63 110.155 175.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 50.0 m -135.51 162.09 33.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.188 -0.46 . . . . 1.9399999999999999 109.773 175.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -144.95 148.87 34.31 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.976 0.417 . . . . 1.27 110.845 -178.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.421 ' HZ2' ' CG ' ' A' ' 56' ' ' ASP . 44.2 mmtm -125.34 109.09 12.36 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.798 -0.816 . . . . 2.71 108.798 174.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 7.9 p -93.78 124.75 37.99 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.721 0.296 . . . . 2.0 111.688 -173.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.485 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 22.1 m-70 -147.95 174.19 12.13 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 121.183 0.516 . . . . 2.6099999999999999 111.122 176.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.688 ' HB ' ' HD2' ' A' ' 97' ' ' PRO . 72.2 p -116.46 164.3 18.8 Favored Pre-proline 0 C--O 1.243 0.746 0 CA-C-N 116.014 -0.539 . . . . 1.27 111.451 -177.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.688 ' HD2' ' HB ' ' A' ' 96' ' ' THR . 14.5 Cg_endo -57.69 -20.75 44.1 Favored 'Trans proline' 0 C--O 1.219 -0.425 0 C-N-CA 122.826 2.35 . . . . 1.0900000000000001 112.138 178.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.548 ' O ' ' HD2' ' A' ' 102' ' ' LYS . 4.0 mm? -62.46 -51.15 68.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.706 0.289 . . . . 2.6200000000000001 110.236 177.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.564 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 3.4 mp0 -61.54 -46.32 90.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.398 . . . . 2.6899999999999999 110.567 177.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -67.03 -42.49 84.78 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.517 -0.473 . . . . 1.6100000000000001 111.75 -177.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.521 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 24.9 t70 -64.87 -33.04 75.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.855 0.36 . . . . 1.23 110.45 -178.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.593 ' O ' ' HG3' ' A' ' 106' ' ' LYS . 1.1 mpmm? -73.9 -20.3 60.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.518 -0.31 . . . . 3.1499999999999999 110.978 177.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 82.1 mt -70.69 -49.73 44.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.082 0.468 . . . . 1.5900000000000001 109.915 174.573 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 101' ' ' ASP . 2.7 ptmt -68.03 -23.68 65.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.08 -0.509 . . . . 2.3199999999999998 110.778 174.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.526 ' HB3' ' HA ' ' A' ' 102' ' ' LYS . 44.2 t -74.92 -75.47 0.17 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.38 -0.373 . . . . 2.21 110.46 177.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.593 ' HG3' ' O ' ' A' ' 102' ' ' LYS . 10.8 pttt -97.42 -53.19 3.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.586 0.231 . . . . 4.4400000000000004 111.023 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 109.07 -3.05 31.51 Favored Glycine 0 C--N 1.329 0.183 0 C-N-CA 120.612 -0.804 . . . . 3.9199999999999999 112.899 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 8.2 t . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.756 -0.64 . . . . 4.9800000000000004 109.63 179.633 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.2 ttp . . . . . 0 N--CA 1.482 1.134 0 N-CA-C 109.572 -0.529 . . . . 36.359999999999999 109.572 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 89.0 7.9 69.82 Favored Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 110.472 -1.051 . . . . 33.770000000000003 110.472 -171.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -96.66 87.05 4.24 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.0 -0.6 . . . . 32.670000000000002 110.091 -177.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.4 m -75.12 135.6 41.15 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.156 -0.475 . . . . 30.75 110.697 -179.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -112.97 117.92 33.39 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.716 -0.476 . . . . 28.739999999999998 109.716 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -122.58 99.36 6.36 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.04 0.448 . . . . 29.030000000000001 112.026 -176.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.8 m80 -78.38 136.28 37.64 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.814 -0.63 . . . . 26.800000000000001 109.502 170.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 78.3 m80 -77.24 115.19 16.81 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.11 -0.495 . . . . 24.5 109.94 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 7.2 p-80 -94.47 138.48 32.34 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.429 -0.582 . . . . 24.210000000000001 109.429 177.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 48.6 t-80 -93.22 98.33 11.21 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.873 -0.417 . . . . 20.899999999999999 109.873 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 21.3 t -68.33 127.9 34.63 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.242 -0.651 . . . . 20.109999999999999 109.242 178.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.0 t -114.35 153.38 29.91 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.944 0.402 . . . . 17.379999999999999 110.477 -175.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 158.61 65.52 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.593 -0.603 . . . . 16.75 111.593 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -94.89 -51.8 4.52 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.132 0.491 . . . . 19.629999999999999 109.857 -177.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -91.48 22.37 4.03 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.844 -0.616 . . . . 14.57 110.205 178.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -68.72 2.21 2.68 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.559 -0.746 . . . . 16.100000000000001 112.642 -175.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 mt -114.96 -10.99 12.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.009 0.433 . . . . 16.719999999999999 110.424 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -118.16 105.87 12.26 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.077 0.465 . . . . 15.609999999999999 111.299 -168.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 29.1 p90 -100.45 -10.84 20.71 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.785 -0.643 . . . . 11.970000000000001 111.108 178.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 57.37 42.02 25.49 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.156 -0.475 . . . . 10.890000000000001 111.97 177.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.3 31.92 2.59 Favored Glycine 0 CA--C 1.519 0.294 0 C-N-CA 120.885 -0.674 . . . . 7.0 113.07 -177.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 19.2 p80 -99.69 10.16 41.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.277 0.561 . . . . 6.5999999999999996 110.27 177.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.2 mmt -110.73 166.62 10.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.59 -0.732 . . . . 4.7999999999999998 109.467 175.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.483 ' O ' HG23 ' A' ' 28' ' ' VAL . 53.5 t -63.07 147.43 50.78 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.731 -0.47 . . . . 2.2000000000000002 109.731 175.085 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.521 HD13 ' HB3' ' A' ' 86' ' ' ASN . 6.3 tp -49.49 -47.74 20.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 N-CA-C 112.19 0.441 . . . . 1.8200000000000001 112.19 -175.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -63.72 -44.08 94.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.802 0.334 . . . . 1.99 110.322 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.462 ' HZ3' ' CD ' ' A' ' 30' ' ' GLU . 30.6 mmmt -64.73 -36.02 82.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.923 -0.58 . . . . 2.9300000000000002 111.235 -178.54 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 24' ' ' CYS . 95.6 t -58.87 -55.54 22.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 N-CA-C 110.37 -0.233 . . . . 1.6299999999999999 110.37 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.416 HG23 HD11 ' A' ' 87' ' ' ILE . 1.9 mp -66.19 -42.19 90.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.894 0.378 . . . . 1.3300000000000001 110.586 -179.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.462 ' CD ' ' HZ3' ' A' ' 27' ' ' LYS . 3.9 tt0 -58.67 -52.2 66.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.909 -0.587 . . . . 2.2000000000000002 111.534 -177.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -73.71 -31.29 63.32 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.413 -0.358 . . . . 1.6699999999999999 110.81 -172.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 mmmp? -60.78 -55.57 31.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.209 -0.45 . . . . 2.5299999999999998 111.578 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.403 HD13 ' N ' ' A' ' 34' ' ' SER . 4.0 pp -70.33 -26.58 63.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.73 0.3 . . . . 1.24 110.8 -179.564 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.495 ' O ' ' HA ' ' A' ' 38' ' ' LYS . 70.0 m -69.22 -34.17 74.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.765 0.316 . . . . 1.6599999999999999 110.518 175.636 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.6 m -71.68 -34.32 69.58 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.909 0.385 . . . . 0.79000000000000004 110.788 175.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.27 -54.85 7.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.012 -0.54 . . . . 1.24 111.92 -177.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.7 mt -89.25 -29.33 19.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.645 0.259 . . . . 1.49 111.066 -176.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.495 ' HA ' ' O ' ' A' ' 34' ' ' SER . 17.5 ttmt 60.99 78.78 0.3 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.737 -0.665 . . . . 3.8500000000000001 111.33 176.716 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.563 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 59.1 Cg_endo -94.76 160.94 1.81 Allowed 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 123.309 2.673 . . . . 0.67000000000000004 113.388 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 31.6 p -86.11 -39.82 16.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.665 0.745 . . . . 1.3700000000000001 109.096 174.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.531 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 89.2 t80 -124.02 128.19 48.99 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.883 -1.053 . . . . 0.83999999999999997 109.395 176.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.466 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 2.7 tm? -140.57 115.79 9.91 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.174 -0.676 . . . . 2.1899999999999999 109.174 -178.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -130.37 132.43 45.8 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.832 0.348 . . . . 2.23 111.437 -177.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.8 mp -108.52 115.7 30.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.986 -0.552 . . . . 2.23 109.855 172.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.436 ' CG2' ' HB3' ' A' ' 56' ' ' ASP . 11.0 m -106.48 149.42 9.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.344 -0.389 . . . . 1.72 110.813 177.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -64.44 120.02 11.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.602 -0.726 . . . . 1.8300000000000001 110.046 176.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.3 tttp -120.23 88.5 2.95 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.885 -0.783 . . . . 3.2400000000000002 108.885 178.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.3 m -60.77 102.01 0.17 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.072 0.463 . . . . 3.3799999999999999 111.741 -175.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 78.7 m -105.41 -66.98 0.94 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.818 -0.628 . . . . 5.1600000000000001 109.562 173.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 157.14 144.7 4.0 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.08 -1.057 . . . . 3.3300000000000001 113.42 175.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 71.5 m 57.82 83.92 0.11 Allowed 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 123.412 0.685 . . . . 4.6299999999999999 112.733 174.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 100.42 -160.89 19.01 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.433 -0.889 . . . . 2.7599999999999998 112.486 175.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.477 ' OG1' ' HA ' ' A' ' 87' ' ' ILE . 37.3 p -77.08 135.23 38.6 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.332 0.587 . . . . 3.98 111.527 -177.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.9 m -144.04 114.43 7.52 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.19 -0.67 . . . . 2.04 109.19 176.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -131.49 147.4 52.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.043 0.449 . . . . 1.3 111.74 -172.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.436 ' HB3' ' CG2' ' A' ' 45' ' ' VAL . 5.6 t70 -110.4 119.03 37.91 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.343 -0.984 . . . . 1.3500000000000001 108.343 173.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -107.03 123.02 47.59 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.117 0.484 . . . . 1.23 111.786 -175.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.8 t -94.41 111.45 25.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.678 -0.692 . . . . 1.1799999999999999 109.203 174.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.499 HG22 ' HA ' ' A' ' 94' ' ' CYS . 0.0 OUTLIER -108.97 115.66 50.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 121.562 0.696 . . . . 1.9399999999999999 110.636 -178.111 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.531 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 85.3 t -112.3 106.17 20.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.025 -0.989 . . . . 1.3700000000000001 109.029 176.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.563 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 29.8 t -145.04 154.8 42.9 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.413 0.523 . . . . 1.3100000000000001 112.413 -172.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.723 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 0.9 OUTLIER -66.87 -19.48 65.74 Favored 'General case' 0 C--O 1.221 -0.419 0 CA-C-N 115.334 -0.848 . . . . 1.6699999999999999 110.742 171.894 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -69.27 2.17 3.14 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.088 0.471 . . . . 1.8100000000000001 111.028 -178.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -124.59 4.25 8.26 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.754 0.312 . . . . 3.8700000000000001 111.126 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.723 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.2 OUTLIER -74.88 -9.6 58.7 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 121.892 -0.505 . . . . 2.1400000000000001 111.636 -176.965 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.6 p-10 -87.44 -9.98 53.17 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.968 0.414 . . . . 2.0299999999999998 109.995 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.8 ttpp 64.67 25.14 13.04 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.174 -0.921 . . . . 3.8599999999999999 111.32 173.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.486 ' HE3' HD11 ' A' ' 70' ' ' LEU . 30.4 mmmt -94.67 89.83 5.89 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.358 0.599 . . . . 2.4900000000000002 109.617 176.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.464 HD11 ' N ' ' A' ' 70' ' ' LEU . 4.0 pp -69.19 -30.31 68.47 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.763 -0.653 . . . . 2.8900000000000001 110.994 -174.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.493 HD21 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.32 -33.88 76.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.651 0.263 . . . . 1.6000000000000001 110.573 177.204 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.493 ' N ' HD21 ' A' ' 70' ' ' LEU . 25.5 t70 -74.22 -40.21 62.6 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.676 -0.49 . . . . 2.0800000000000001 109.676 178.188 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -59.11 -44.44 91.99 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.425 -0.583 . . . . 3.4199999999999999 109.425 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -57.7 -55.25 37.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.662 -0.699 . . . . 1.3700000000000001 111.255 178.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.465 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 2.3 ptm180 -61.5 -41.51 97.39 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 111.784 0.29 . . . . 2.1000000000000001 111.784 -175.558 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.5 mt -64.18 -50.88 66.39 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.883 0.373 . . . . 2.1299999999999999 110.786 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 54.1 t -56.28 -45.7 81.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.84 -0.618 . . . . 1.4099999999999999 110.92 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -64.36 -31.29 72.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.633 -0.258 . . . . 1.21 111.413 -178.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 85.2 m -66.03 -49.32 68.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.572 -0.286 . . . . 1.3200000000000001 111.408 -178.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.1 mp -79.45 -46.0 23.27 Favored 'Isoleucine or valine' 0 C--O 1.242 0.666 0 CA-C-O 121.364 0.602 . . . . 1.46 110.701 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.807 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.8 mp -73.15 -5.46 39.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.074 -0.512 . . . . 1.3799999999999999 111.711 -175.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -49.46 -63.94 0.95 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.215 -0.291 . . . . 2.4199999999999999 110.215 171.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.465 ' O ' ' HG2' ' A' ' 85' ' ' GLN . 6.0 tp10 -75.1 -37.6 61.45 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.264 0.554 . . . . 2.9100000000000001 110.507 175.85 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.807 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 3.8 tp10 -53.01 -55.15 25.78 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.412 -0.813 . . . . 1.6599999999999999 112.603 -174.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.654 ' HG ' ' HB3' ' A' ' 80' ' ' LEU . 55.3 mt -50.4 -30.53 12.62 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.846 -1.07 . . . . 1.27 113.386 -176.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 19.5 mm-40 -51.16 -27.35 8.44 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.018 0.372 . . . . 0.96999999999999997 111.67 -176.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.521 ' HB3' HD13 ' A' ' 25' ' ' ILE . 44.5 m-80 -77.74 -24.82 48.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.386 -0.37 . . . . 1.02 111.337 -178.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.477 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 1.8 mt -103.64 156.87 5.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.451 -0.574 . . . . 1.3100000000000001 109.451 -176.265 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 39.4 t60 -98.46 -36.73 9.85 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.548 -0.461 . . . . 2.29 110.173 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -147.54 96.84 2.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.118 -0.492 . . . . 1.3999999999999999 110.679 178.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -101.09 136.09 41.49 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.174 -0.466 . . . . 0.63 110.887 178.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 33.0 t -125.76 152.51 45.28 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.111 -0.7 . . . . 1.9399999999999999 109.111 177.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -143.39 134.72 26.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.306 0.574 . . . . 1.27 111.505 -177.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -117.42 109.28 16.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.646 -0.706 . . . . 2.71 109.412 174.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.499 ' HA ' HG22 ' A' ' 59' ' ' ILE . 7.5 p -92.77 130.62 38.32 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.276 0.56 . . . . 2.0 111.555 -176.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.407 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 40.3 m80 -143.88 167.08 23.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.586 -0.733 . . . . 2.6099999999999999 110.017 178.174 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 39.1 p -101.63 159.15 30.26 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 116.238 -0.437 . . . . 1.27 110.006 176.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -58.68 -29.44 89.43 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.252 1.968 . . . . 1.0900000000000001 111.166 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.85 -45.48 70.97 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.542 -0.754 . . . . 2.6200000000000001 109.781 177.129 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.477 ' HA ' ' CE ' ' A' ' 102' ' ' LYS . 8.5 tp10 -61.95 -42.55 99.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.044 0.449 . . . . 2.6899999999999999 110.284 177.656 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.608 ' O ' ' HG2' ' A' ' 104' ' ' LYS . 64.9 t80 -64.66 -32.53 74.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.683 -0.689 . . . . 1.6100000000000001 110.429 178.062 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -59.45 -36.49 76.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.052 -0.522 . . . . 1.23 111.266 -178.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.477 ' CE ' ' HA ' ' A' ' 99' ' ' GLU . 0.0 OUTLIER -63.64 -44.66 93.19 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.962 -0.295 . . . . 3.1499999999999999 110.518 176.592 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 51.7 mt -63.04 -51.5 66.49 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.177 -0.465 . . . . 1.5900000000000001 110.948 -176.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.608 ' HG2' ' O ' ' A' ' 100' ' ' TYR . 19.3 ptmt -68.35 -18.72 64.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.796 -0.638 . . . . 2.3199999999999998 111.755 -177.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 47.4 t -62.12 -26.26 68.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.834 0.349 . . . . 2.21 111.041 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.71 -39.48 3.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.021 0.439 . . . . 4.4400000000000004 110.532 176.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 104.7 47.82 1.15 Allowed Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.999 -0.619 . . . . 3.9199999999999999 111.699 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 24.1 m . . . . . 0 C--O 1.252 1.211 0 CA-C-O 118.491 -0.766 . . . . 4.9800000000000004 109.828 -179.547 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 tpt . . . . . 0 N--CA 1.48 1.073 0 CA-C-O 120.942 0.401 . . . . 36.359999999999999 110.519 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 166.42 168.05 28.02 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 111.131 -0.788 . . . . 33.770000000000003 111.131 178.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.1 t -74.83 90.3 2.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.283 0.563 . . . . 32.670000000000002 109.831 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.6 m -84.68 91.87 8.04 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.901 -0.591 . . . . 30.75 110.991 -176.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 59.5 m-70 -95.41 -172.36 2.62 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.191 -0.459 . . . . 28.739999999999998 110.485 179.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 -124.38 -47.41 1.87 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.708 -0.478 . . . . 29.030000000000001 109.708 178.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 69.38 -52.79 0.6 Allowed 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.275 1.03 . . . . 26.800000000000001 111.673 178.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 -64.23 135.27 56.12 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.96 -0.755 . . . . 24.5 108.96 177.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 46.6 m80 -84.54 -79.38 0.22 Allowed 'General case' 0 C--N 1.323 -0.582 0 O-C-N 123.388 0.43 . . . . 24.210000000000001 112.042 -167.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -143.53 133.52 24.15 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.358 -0.383 . . . . 20.899999999999999 110.147 -172.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.5 m -105.05 -163.34 0.95 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.192 -0.458 . . . . 20.109999999999999 110.143 -178.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.7 m -98.0 70.86 2.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.239 0.542 . . . . 17.379999999999999 110.578 176.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.467 ' HA3' ' HG3' ' A' ' 43' ' ' GLU . . . -117.38 23.76 9.55 Favored Glycine 0 N--CA 1.452 -0.24 0 N-CA-C 110.601 -1.0 . . . . 16.75 110.601 178.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -67.66 -32.47 73.18 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.392 -0.904 . . . . 19.629999999999999 111.631 -175.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -129.45 12.55 5.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.143 0.497 . . . . 14.57 110.582 -173.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -73.18 -6.51 46.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.973 -0.558 . . . . 16.100000000000001 111.207 -173.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -71.97 -1.31 14.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.445 -0.343 . . . . 16.719999999999999 111.893 -174.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -97.24 131.7 43.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.899 0.381 . . . . 15.609999999999999 110.473 177.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -90.03 -30.58 17.65 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.01 -0.541 . . . . 11.970000000000001 110.284 -174.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 66.58 19.54 10.83 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.263 -0.88 . . . . 10.890000000000001 111.041 177.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.03 -2.53 86.73 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.995 -0.621 . . . . 7.0 112.783 178.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 32.2 m170 -96.39 107.86 20.31 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.737 -0.272 . . . . 6.5999999999999996 110.403 -178.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.8 ptt? -79.81 65.7 5.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.684 0.754 . . . . 4.7999999999999998 110.831 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 33.7 m -68.82 155.97 39.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.378 -0.828 . . . . 2.2000000000000002 110.126 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.9 tp -56.1 -35.62 42.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 O-C-N 123.075 0.235 . . . . 1.8200000000000001 110.893 -178.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.47 HE21 ' HG ' ' A' ' 44' ' ' LEU . 39.0 tt0 -53.27 -49.98 65.8 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.86 0.362 . . . . 1.99 110.763 175.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.458 ' HD3' ' HA ' ' A' ' 27' ' ' LYS . 70.3 mmtt -71.32 -23.89 62.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.965 -0.562 . . . . 2.9300000000000002 112.187 -174.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 46.4 t -67.22 -52.21 45.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-O 121.163 0.506 . . . . 1.6299999999999999 109.844 176.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.418 HG13 ' OE1' ' A' ' 83' ' ' GLU . 1.8 mp -60.42 -48.56 87.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.413 -0.812 . . . . 1.3300000000000001 109.905 175.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -56.4 -49.71 73.72 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.086 -0.961 . . . . 2.2000000000000002 111.117 -178.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -56.33 -50.74 70.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.146 -0.479 . . . . 1.6699999999999999 111.767 -177.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.464 ' HZ2' ' CD ' ' A' ' 83' ' ' GLU . 5.3 mtmp? -63.28 -46.83 84.94 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.415 0.524 . . . . 2.5299999999999998 112.415 -175.523 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.438 HD12 ' N ' ' A' ' 34' ' ' SER . 4.3 pp -71.42 -28.83 64.27 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.24 -0.584 . . . . 1.24 110.848 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.438 ' N ' HD12 ' A' ' 33' ' ' LEU . 23.1 t -69.21 -36.93 77.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.931 0.396 . . . . 1.6599999999999999 110.149 177.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.1 m -71.6 -28.0 63.51 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.409 -0.359 . . . . 0.79000000000000004 111.189 178.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.09 -54.92 5.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.313 -0.403 . . . . 1.24 112.005 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.6 mp -88.86 -25.68 22.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.601 0.238 . . . . 1.49 110.639 -177.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.469 ' HB2' ' HE2' ' A' ' 38' ' ' LYS . 19.9 ttmm 59.82 78.18 0.35 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.56 -0.746 . . . . 3.8500000000000001 111.373 177.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.869 ' HA ' ' HB3' ' A' ' 61' ' ' SER . 97.4 Cg_endo -93.0 157.93 2.68 Favored 'Trans proline' 0 N--CA 1.451 -1.024 0 C-N-CA 123.177 2.585 . . . . 0.67000000000000004 113.167 -177.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.0 p -89.65 -28.05 19.74 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.813 -0.63 . . . . 1.3700000000000001 109.826 175.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.419 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 83.4 t80 -138.3 139.77 39.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.687 -0.688 . . . . 0.83999999999999997 110.13 178.233 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.616 HD21 ' HA ' ' A' ' 59' ' ' ILE . 0.2 OUTLIER -142.21 116.36 9.45 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.228 -0.656 . . . . 2.1899999999999999 109.228 179.135 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.467 ' HG3' ' HA3' ' A' ' 13' ' ' GLY . 21.4 tt0 -114.54 127.78 55.98 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.947 0.403 . . . . 2.23 110.263 177.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.47 ' HG ' HE21 ' A' ' 26' ' ' GLN . 3.7 mm? -98.94 115.79 29.7 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.765 -0.652 . . . . 2.23 110.214 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.521 ' HB ' ' HB3' ' A' ' 56' ' ' ASP . 29.6 t -103.49 146.22 11.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.453 -0.794 . . . . 1.72 109.32 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -69.79 129.87 40.75 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.832 -0.433 . . . . 1.8300000000000001 109.832 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.679 ' HA ' ' HE3' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -72.41 -31.9 65.9 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.047 0.451 . . . . 3.2400000000000002 110.044 -179.883 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.2 t -172.68 98.91 0.14 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.426 -0.806 . . . . 3.3799999999999999 109.069 -178.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 70.9 m -54.37 110.9 0.68 Allowed 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.741 -0.663 . . . . 5.1600000000000001 110.768 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 143.47 -31.49 1.92 Allowed Glycine 0 N--CA 1.442 -0.913 0 CA-C-N 115.069 -0.968 . . . . 3.3300000000000001 111.334 -177.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 57.9 m -131.29 105.03 7.38 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.891 0.377 . . . . 4.6299999999999999 110.359 178.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -83.84 54.27 4.93 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.992 -0.623 . . . . 2.7599999999999998 112.303 -178.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.7 t -126.4 -1.31 6.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.299 0.571 . . . . 3.98 110.657 -179.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.0 p -137.77 138.29 39.1 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.377 -0.374 . . . . 2.04 110.288 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -128.3 152.45 48.12 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.251 0.548 . . . . 1.3 111.652 -175.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.521 ' HB3' ' HB ' ' A' ' 45' ' ' VAL . 13.7 t70 -113.67 134.2 54.87 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.232 -1.025 . . . . 1.3500000000000001 108.232 174.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -125.31 120.99 32.71 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.279 0.561 . . . . 1.23 112.378 -174.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.3 t -92.52 110.98 23.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.484 -0.78 . . . . 1.1799999999999999 108.996 171.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.907 HD12 ' HG ' ' A' ' 61' ' ' SER . 0.0 OUTLIER -105.4 120.47 56.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.252 -0.431 . . . . 1.9399999999999999 110.576 -176.899 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.474 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 58.1 t -115.79 106.92 21.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.73 -0.668 . . . . 1.3700000000000001 110.373 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.907 ' HG ' HD12 ' A' ' 59' ' ' ILE . 86.9 p -153.37 153.09 31.9 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.884 0.374 . . . . 1.3100000000000001 111.048 -179.019 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.844 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 23.9 m-80 -67.17 -19.35 65.57 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.122 -0.49 . . . . 1.6699999999999999 112.078 175.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -52.5 -25.43 10.25 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.868 -0.52 . . . . 1.8100000000000001 111.505 -177.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -100.37 -1.34 36.28 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.685 0.624 . . . . 3.8700000000000001 112.685 -174.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.844 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -72.98 -15.59 61.54 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.542 -0.724 . . . . 2.1400000000000001 111.669 -178.938 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -80.18 5.25 14.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.136 0.493 . . . . 2.0299999999999998 110.317 -178.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt 62.58 26.74 15.86 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.355 -0.839 . . . . 3.8599999999999999 110.803 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.57 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 71.0 mmtt -83.77 97.9 9.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.912 -0.586 . . . . 2.4900000000000002 111.799 -177.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -73.69 -44.11 57.45 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 115.404 -0.817 . . . . 2.8900000000000001 108.906 175.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.478 HD21 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.74 -33.17 74.34 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.012 -0.54 . . . . 1.6000000000000001 111.503 -178.042 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.57 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 30.6 t70 -66.82 -50.29 63.08 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 109.749 -0.463 . . . . 2.0800000000000001 109.749 177.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -57.42 -43.64 83.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.74 -0.664 . . . . 3.4199999999999999 109.591 176.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -61.45 -50.94 70.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.658 -0.701 . . . . 1.3700000000000001 111.708 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.07 -35.81 66.74 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.072 -0.251 . . . . 2.1000000000000001 111.319 -174.358 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.0 mp -64.3 -50.09 69.21 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.792 0.33 . . . . 2.1299999999999999 110.801 177.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.779 HG13 HD23 ' A' ' 80' ' ' LEU . 42.0 t -58.73 -47.52 88.77 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.4 0 CA-C-N 116.048 -0.524 . . . . 1.4099999999999999 110.976 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.421 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 13.2 m-80 -62.47 -38.26 89.15 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.905 -0.318 . . . . 1.21 111.702 -178.255 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 87.6 m -61.4 -57.87 10.5 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.06 0.393 . . . . 1.3200000000000001 112.06 -177.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.7 mp -81.37 -46.09 20.47 Favored 'Isoleucine or valine' 0 C--O 1.239 0.522 0 CA-C-O 121.457 0.646 . . . . 1.46 110.839 -175.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.839 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.6 mp -74.55 -5.35 42.32 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.867 -0.606 . . . . 1.3799999999999999 111.504 -175.204 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.421 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 20.5 tptm -49.73 -63.64 1.05 Allowed 'General case' 0 C--O 1.227 -0.117 0 N-CA-C 109.772 -0.455 . . . . 2.4199999999999999 109.772 169.091 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -75.2 -30.19 60.57 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.294 0.569 . . . . 2.9100000000000001 110.322 179.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.839 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 6.7 tp10 -56.8 -55.59 32.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.553 -0.748 . . . . 1.6599999999999999 112.001 -179.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.646 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 75.0 mt -50.37 -30.77 13.0 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.173 -0.921 . . . . 1.27 112.634 -178.361 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 22.2 mm-40 -52.76 -30.76 34.62 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 120.954 0.407 . . . . 0.96999999999999997 111.163 -176.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -96.57 5.36 50.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.199 -0.455 . . . . 1.02 111.395 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 9.1 mt -122.89 136.62 59.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.507 -0.315 . . . . 1.3100000000000001 110.285 -178.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -73.38 -38.68 65.58 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.939 0.399 . . . . 2.29 110.226 179.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.32 102.0 1.09 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.899 -0.592 . . . . 1.3999999999999999 110.416 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -94.64 140.22 30.16 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.388 -0.369 . . . . 0.63 110.221 177.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.8 m -128.83 140.19 51.82 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.335 -0.617 . . . . 1.9399999999999999 109.335 176.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -129.71 133.3 46.97 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.149 0.5 . . . . 1.27 110.909 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 42.1 tptt -124.34 116.36 22.47 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.996 -0.547 . . . . 2.71 109.927 174.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.499 ' HA ' HG22 ' A' ' 59' ' ' ILE . 65.9 m -89.22 134.37 34.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.835 -0.621 . . . . 2.0 111.753 -173.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.474 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 55.9 m-70 -136.84 153.48 50.77 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.187 -0.915 . . . . 2.6099999999999999 109.393 175.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.426 HG21 ' HB3' ' A' ' 65' ' ' GLU . 0.6 OUTLIER -93.54 150.71 39.31 Favored Pre-proline 0 C--N 1.314 -0.958 0 CA-C-N 116.282 -0.417 . . . . 1.27 110.173 174.579 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.528 ' HG2' ' ND2' ' A' ' 62' ' ' ASN . 50.3 Cg_exo -57.09 -31.85 91.54 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.707 2.271 . . . . 1.0900000000000001 112.072 -179.244 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -67.64 -50.86 55.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.528 -0.76 . . . . 2.6200000000000001 110.229 176.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.67 -27.31 66.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.541 -0.299 . . . . 2.6899999999999999 111.636 -178.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -73.77 -32.69 63.92 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.766 -0.457 . . . . 1.6100000000000001 109.766 173.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.53 ' HA ' ' HE3' ' A' ' 104' ' ' LYS . 12.9 t70 -59.5 -42.64 92.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.809 -0.632 . . . . 1.23 109.855 177.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.8 -32.57 65.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.899 -0.591 . . . . 3.1499999999999999 110.985 177.12 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 70.2 mt -79.11 -40.2 31.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 1.5900000000000001 112.088 -176.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.557 ' HD2' ' N ' ' A' ' 105' ' ' SER . 0.1 OUTLIER -91.0 -28.73 17.81 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.503 0.557 . . . . 2.3199999999999998 112.503 -175.301 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.557 ' N ' ' HD2' ' A' ' 104' ' ' LYS . 60.5 m -73.49 -37.49 65.69 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.902 -0.319 . . . . 2.21 111.096 -177.096 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.425 ' HZ2' ' C ' ' A' ' 108' ' ' SER . 0.0 OUTLIER -158.16 -172.01 3.73 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.105 0.478 . . . . 4.4400000000000004 111.307 -178.565 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -129.34 4.81 6.3 Favored Glycine 0 N--CA 1.451 -0.361 0 CA-C-N 115.468 -0.787 . . . . 3.9199999999999999 111.33 177.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' SER . . . . . 0.425 ' C ' ' HZ2' ' A' ' 106' ' ' LYS . 18.9 t . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.464 -0.779 . . . . 4.9800000000000004 109.022 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.9 mtt . . . . . 0 N--CA 1.482 1.161 0 CA-C-O 120.53 0.205 . . . . 36.359999999999999 110.478 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 77.95 -125.4 7.2 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.809 -0.71 . . . . 33.770000000000003 111.542 -178.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 6.3 t -142.94 126.53 16.89 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.498 -0.556 . . . . 32.670000000000002 109.498 176.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.5 m -83.79 85.01 7.36 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.038 0.447 . . . . 30.75 111.163 -175.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 25.9 m-70 -119.42 80.42 1.56 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.436 0.636 . . . . 28.739999999999998 111.147 177.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -157.17 96.5 1.58 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.118 -0.946 . . . . 29.030000000000001 108.565 174.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 59.7 t60 -95.35 131.15 41.76 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.716 -0.675 . . . . 26.800000000000001 111.857 -170.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -139.34 126.47 21.21 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.328 -0.851 . . . . 24.5 109.699 171.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -82.15 71.57 9.2 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.796 -0.816 . . . . 24.210000000000001 108.796 176.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.469 ' CD2' ' HG3' ' A' ' 15' ' ' GLU . 0.9 OUTLIER -84.1 174.43 10.27 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.06 -0.973 . . . . 20.899999999999999 111.243 -178.701 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.8 m -54.32 126.65 24.04 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.569 -0.741 . . . . 20.109999999999999 111.631 -176.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 28.7 m -78.01 88.35 4.16 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.484 0.659 . . . . 17.379999999999999 110.306 178.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 171.0 -78.79 0.09 OUTLIER Glycine 0 N--CA 1.442 -0.903 0 CA-C-N 114.966 -1.015 . . . . 16.75 111.277 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -58.01 -27.77 63.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.472 -0.364 . . . . 19.629999999999999 111.719 -176.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.469 ' HG3' ' CD2' ' A' ' 10' ' ' HIS . 12.8 pt-20 -145.65 36.63 1.07 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.968 0.413 . . . . 14.57 111.315 -174.133 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.506 HD22 ' HG3' ' A' ' 43' ' ' GLU . 3.1 p30 -96.68 -18.49 19.65 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.513 -0.475 . . . . 16.100000000000001 111.074 -178.071 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -82.05 5.18 20.25 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.63 -0.259 . . . . 16.719999999999999 111.519 -176.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -81.53 -179.37 7.35 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.485 0.66 . . . . 15.609999999999999 112.165 -176.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 14.3 p90 -68.15 -8.45 38.68 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.112 -0.949 . . . . 11.970000000000001 113.48 -171.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.501 HE21 ' N ' ' A' ' 21' ' ' GLY . 0.4 OUTLIER -74.2 -14.46 60.94 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.095 0.474 . . . . 10.890000000000001 110.333 -177.936 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.501 ' N ' HE21 ' A' ' 20' ' ' GLN . . . -91.98 74.06 1.5 Allowed Glycine 0 N--CA 1.446 -0.684 0 CA-C-N 115.806 -0.633 . . . . 7.0 111.824 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 1.8 m80 -102.32 -156.28 0.55 Allowed 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.523 -0.177 . . . . 6.5999999999999996 110.523 178.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.7 ptt? -50.3 129.41 21.5 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.374 0.607 . . . . 4.7999999999999998 111.801 -175.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.502 ' O ' HG23 ' A' ' 28' ' ' VAL . 48.2 t -176.27 164.51 2.69 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.85 -1.167 . . . . 2.2000000000000002 107.85 -175.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 7.0 tp -59.08 -38.7 75.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.106 0.479 . . . . 1.8200000000000001 110.218 177.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -63.4 -39.27 94.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.912 -0.586 . . . . 1.99 110.165 176.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -69.66 -33.83 73.14 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.98 -0.555 . . . . 2.9300000000000002 110.782 -179.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 24' ' ' CYS . 94.8 t -57.61 -53.02 50.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 110.202 -0.296 . . . . 1.6299999999999999 110.202 176.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.9 mp -68.08 -45.35 83.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.244 -0.434 . . . . 1.3300000000000001 111.181 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -61.38 -52.27 65.31 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.648 0.261 . . . . 2.2000000000000002 110.934 -176.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -69.56 -27.17 64.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.491 -0.322 . . . . 1.6699999999999999 110.786 -176.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.424 ' HE2' ' HB3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -62.61 -55.65 25.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.189 -0.46 . . . . 2.5299999999999998 111.172 178.489 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.425 HD11 ' N ' ' A' ' 34' ' ' SER . 3.8 pp -74.26 -30.11 61.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.538 -0.301 . . . . 1.24 111.135 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.425 ' N ' HD11 ' A' ' 33' ' ' LEU . 23.1 t -63.9 -51.59 63.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.419 -0.355 . . . . 1.6599999999999999 110.837 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.0 m -71.27 -27.23 63.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.568 -0.287 . . . . 0.79000000000000004 111.284 -177.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.28 -53.89 7.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.522 -0.308 . . . . 1.24 111.678 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.4 mt -83.49 -34.97 25.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.525 -0.307 . . . . 1.49 111.344 -176.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.4 mttp 62.83 85.71 0.16 Allowed Pre-proline 0 N--CA 1.464 0.233 0 CA-C-N 115.636 -0.711 . . . . 3.8500000000000001 111.927 -177.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -94.49 157.89 1.98 Allowed 'Trans proline' 0 N--CA 1.45 -1.067 0 C-N-CA 123.164 2.576 . . . . 0.67000000000000004 112.162 175.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 21.5 p -78.81 -29.48 44.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.413 0.625 . . . . 1.3700000000000001 109.539 176.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.472 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 82.9 t80 -141.68 134.49 28.7 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.068 -0.969 . . . . 0.83999999999999997 109.841 175.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -140.63 112.72 7.75 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.024 -0.732 . . . . 2.1899999999999999 109.024 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.506 ' HG3' HD22 ' A' ' 16' ' ' ASN . 39.0 tt0 -113.37 122.32 47.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.76 -0.459 . . . . 2.23 109.76 177.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.461 HD13 ' HB3' ' A' ' 55' ' ' PHE . 0.1 OUTLIER -97.97 115.36 28.01 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.618 -0.512 . . . . 2.23 109.618 179.727 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 39.0 t -112.93 135.34 52.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 116.594 -0.276 . . . . 1.72 110.81 -176.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -67.72 112.86 5.05 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.211 -0.663 . . . . 1.8300000000000001 109.211 171.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.416 ' HB3' ' OG ' ' A' ' 54' ' ' SER . 56.4 tttp -82.94 -27.76 30.32 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.784 -0.644 . . . . 3.2400000000000002 110.787 -173.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.0 m 57.25 27.83 14.24 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.916 -0.583 . . . . 3.3799999999999999 111.47 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 37.4 t -87.5 108.85 19.22 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.554 -0.535 . . . . 5.1600000000000001 109.554 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 88.79 -116.19 4.6 Favored Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 120.587 -0.816 . . . . 3.3300000000000001 111.289 -176.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 76.7 m -152.47 155.74 38.09 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.067 -0.345 . . . . 4.6299999999999999 110.067 178.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.07 -140.26 22.08 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.925 -0.655 . . . . 2.7599999999999998 112.788 176.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.5 p -75.2 102.39 4.97 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 121.508 0.67 . . . . 3.98 111.172 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.416 ' OG ' ' HB3' ' A' ' 47' ' ' LYS . 32.6 t -125.31 114.11 18.47 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.06 -0.718 . . . . 2.04 109.06 176.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.461 ' HB3' HD13 ' A' ' 44' ' ' LEU . 41.9 m-85 -124.67 132.62 53.39 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.858 0.361 . . . . 1.3 111.268 -172.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -115.46 114.46 25.07 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 107.423 -1.325 . . . . 1.3500000000000001 107.423 171.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.05 117.76 34.88 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.026 0.441 . . . . 1.23 111.523 -172.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.8 t -80.4 110.78 16.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 108.985 -0.746 . . . . 1.1799999999999999 108.985 173.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -112.65 112.6 41.14 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.663 0.744 . . . . 1.9399999999999999 110.376 -176.25 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 75.3 t -110.26 108.72 26.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.082 -0.963 . . . . 1.3700000000000001 108.931 175.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.1 t -149.04 155.04 40.17 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.359 0.6 . . . . 1.3100000000000001 112.402 -172.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -66.99 -19.44 65.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 114.922 -1.035 . . . . 1.6699999999999999 111.602 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 35.0 p30 -68.33 -25.39 65.09 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.852 -0.339 . . . . 1.8100000000000001 111.244 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.48 ' HD2' HG23 ' A' ' 96' ' ' THR . 57.6 t80 -85.72 -12.78 50.28 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.454 0.645 . . . . 3.8700000000000001 109.723 176.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.47 -24.64 34.14 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.299 -0.864 . . . . 2.1400000000000001 109.027 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -67.49 -21.25 65.52 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.325 -0.852 . . . . 2.0299999999999998 109.065 173.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt 65.06 23.66 12.47 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.005 -0.998 . . . . 3.8599999999999999 110.966 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -90.74 89.82 7.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.956 -0.566 . . . . 2.4900000000000002 110.098 177.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.4 tt -61.65 -49.83 74.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.437 -0.801 . . . . 2.8900000000000001 110.733 -175.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.409 HD23 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -63.49 -31.66 72.89 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.716 0.265 . . . . 1.6000000000000001 111.716 -178.586 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.637 ' O ' ' HG2' ' A' ' 74' ' ' ARG . 12.4 m-20 -73.98 -46.23 45.13 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.113 -0.235 . . . . 2.0800000000000001 111.42 -179.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -67.3 -26.68 66.64 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.391 -0.524 . . . . 3.4199999999999999 109.92 176.479 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -70.94 -48.01 55.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.066 -0.516 . . . . 1.3700000000000001 110.473 176.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.637 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 7.7 ptm180 -63.69 -34.69 78.42 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.524 -0.307 . . . . 2.1000000000000001 110.759 -178.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 95.3 mt -68.03 -50.12 57.3 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.378 -0.374 . . . . 2.1299999999999999 110.2 177.393 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.572 HG13 HD23 ' A' ' 80' ' ' LEU . 43.5 t -57.4 -41.34 78.34 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 CA-C-N 116.019 -0.537 . . . . 1.4099999999999999 110.781 178.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -62.15 -45.74 92.06 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.775 0.321 . . . . 1.21 111.203 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 59.1 m -65.52 -45.86 81.84 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.038 0.447 . . . . 1.3200000000000001 111.361 -175.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 47.3 mt -77.46 -50.68 19.84 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 CA-C-O 121.464 0.65 . . . . 1.46 110.985 -176.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.846 ' HA ' ' CB ' ' A' ' 83' ' ' GLU . 9.7 mp -77.27 -3.97 42.53 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.636 -0.711 . . . . 1.3799999999999999 111.903 -173.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.2 tptt -52.35 -63.68 1.06 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.601 -0.518 . . . . 2.4199999999999999 109.601 172.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -75.53 -30.56 59.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.438 -0.347 . . . . 2.9100000000000001 111.243 174.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.846 ' CB ' ' HA ' ' A' ' 80' ' ' LEU . 2.6 tp10 -54.28 -54.7 36.67 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.048 0.451 . . . . 1.6599999999999999 111.585 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.73 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 66.0 mt -50.34 -30.86 13.09 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.203 -0.908 . . . . 1.27 112.317 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -54.19 -28.14 38.64 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.757 0.313 . . . . 0.96999999999999997 111.128 -177.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -90.34 -6.89 54.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.869 0.366 . . . . 1.02 111.136 -178.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.514 HG22 ' HB2' ' A' ' 90' ' ' PHE . 4.2 mt -114.9 146.49 19.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.297 -0.411 . . . . 1.3100000000000001 109.944 -175.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 60.9 t60 -95.01 -28.7 14.99 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.848 0.356 . . . . 2.29 110.079 176.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -158.68 95.58 1.32 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.18 -0.464 . . . . 1.3999999999999999 110.994 178.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . 0.514 ' HB2' HG22 ' A' ' 87' ' ' ILE . 81.9 t80 -99.39 144.5 28.43 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.222 -0.445 . . . . 0.63 110.702 176.23 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 51.1 m -142.82 147.45 35.47 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.458 -0.571 . . . . 1.9399999999999999 109.458 173.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -115.19 137.15 52.34 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.279 0.561 . . . . 1.27 111.248 -177.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.609 ' HB2' ' HZ2' ' A' ' 93' ' ' LYS . 0.1 OUTLIER -111.62 108.84 18.46 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 107.955 -1.128 . . . . 2.71 107.955 175.229 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 6.3 p -100.1 128.57 46.16 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.414 0.524 . . . . 2.0 112.414 -169.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.524 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 44.5 m80 -141.58 159.79 41.49 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-O 121.543 0.687 . . . . 2.6099999999999999 111.52 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.48 HG23 ' HD2' ' A' ' 64' ' ' PHE . 0.6 OUTLIER -103.28 149.6 37.12 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 114.932 -1.031 . . . . 1.27 110.67 177.362 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.437 ' HA ' ' HB3' ' A' ' 100' ' ' TYR . 22.2 Cg_endo -61.79 -24.81 77.85 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.838 2.359 . . . . 1.0900000000000001 112.876 -178.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.403 HD21 ' HA ' ' A' ' 98' ' ' LEU . 0.3 OUTLIER -61.87 -51.41 68.33 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.803 -0.443 . . . . 2.6200000000000001 109.803 179.047 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 19.7 mp0 -72.77 -33.36 66.26 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.084 -0.507 . . . . 2.6899999999999999 111.118 177.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.437 ' HB3' ' HA ' ' A' ' 97' ' ' PRO . 50.0 t80 -58.65 -39.84 81.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.428 -0.351 . . . . 1.6100000000000001 111.241 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -57.16 -36.1 70.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.997 0.427 . . . . 1.23 110.657 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.71 ' HE2' ' N ' ' A' ' 102' ' ' LYS . 0.5 OUTLIER -70.44 -35.76 73.55 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.191 -0.459 . . . . 3.1499999999999999 110.396 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 86.3 mt -65.18 -43.43 91.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 1.5900000000000001 111.12 -178.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.2 ptmt -75.84 -31.29 59.27 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.373 -0.376 . . . . 2.3199999999999998 111.023 178.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.3 t -70.04 -42.64 72.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.782 0.325 . . . . 2.21 110.736 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.64 ' HE2' ' HB2' ' A' ' 108' ' ' SER . 22.7 ptmt -70.84 -46.23 63.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.11 0.481 . . . . 4.4400000000000004 109.947 177.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 100.74 40.21 2.97 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.953 -0.641 . . . . 3.9199999999999999 111.791 178.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' SER . . . . . 0.64 ' HB2' ' HE2' ' A' ' 106' ' ' LYS . 67.8 m . . . . . 0 C--O 1.249 1.026 0 CA-C-O 118.096 -0.954 . . . . 4.9800000000000004 109.459 178.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 N--CA 1.48 1.064 0 N-CA-C 110.062 -0.348 . . . . 36.359999999999999 110.062 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -153.32 54.26 0.45 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.718 -0.753 . . . . 33.770000000000003 112.24 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.6 m -114.63 110.67 20.13 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.823 0.344 . . . . 32.670000000000002 110.602 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 32.5 t -127.41 109.37 11.7 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.065 -0.516 . . . . 30.75 109.967 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.8 p80 -140.42 119.16 12.45 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.141 0.496 . . . . 28.739999999999998 110.971 -179.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 57.0 m-70 -112.31 105.24 13.48 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.072 -0.513 . . . . 29.030000000000001 110.231 175.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 75.8 t60 -75.32 111.04 10.18 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.115 -0.493 . . . . 26.800000000000001 110.402 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.5 m-70 -88.59 86.58 7.03 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.391 0.615 . . . . 24.5 111.015 -177.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 61.4 t60 -177.83 81.39 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.842 -1.072 . . . . 24.210000000000001 108.385 175.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.5 p80 -91.03 121.94 33.27 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.792 -0.64 . . . . 20.899999999999999 110.947 -175.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.601 ' HB2' ' HG2' ' A' ' 14' ' ' ARG . 16.3 m -75.36 148.17 39.46 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.282 -0.636 . . . . 20.109999999999999 109.282 174.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.6 m -94.68 105.84 17.8 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.112 0.482 . . . . 17.379999999999999 111.341 -174.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 93.78 40.46 4.66 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-N 115.81 -0.632 . . . . 16.75 112.426 177.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.601 ' HG2' ' HB2' ' A' ' 11' ' ' SER . 38.8 mtm180 -65.89 -38.9 89.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.24 0.543 . . . . 19.629999999999999 110.696 -179.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -86.45 30.78 0.69 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.764 -0.653 . . . . 14.57 111.558 -176.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -66.14 -13.28 59.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.405 -0.361 . . . . 16.100000000000001 110.888 178.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.3 mp -70.63 -28.48 64.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.341 0.591 . . . . 16.719999999999999 109.813 174.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -96.81 167.74 10.92 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.379 -0.828 . . . . 15.609999999999999 109.796 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.451 ' CE2' ' HA3' ' A' ' 21' ' ' GLY . 17.0 p90 -96.73 15.57 21.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.446 -0.343 . . . . 11.970000000000001 111.095 -176.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 63.86 35.23 11.16 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.825 -0.625 . . . . 10.890000000000001 110.606 179.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.451 ' HA3' ' CE2' ' A' ' 19' ' ' PHE . . . -103.15 66.08 0.36 Allowed Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.825 -0.702 . . . . 7.0 112.057 -179.123 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 13.9 m-70 -80.24 -67.73 0.74 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.006 -1.109 . . . . 6.5999999999999996 108.006 176.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.4 mtt -128.1 89.86 2.99 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.828 -1.078 . . . . 4.7999999999999998 108.789 171.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.516 ' O ' HG23 ' A' ' 28' ' ' VAL . 53.3 t -58.88 119.6 7.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.876 -0.602 . . . . 2.2000000000000002 110.523 -178.126 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.9 tp -52.54 -31.99 16.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 O-C-N 123.642 0.589 . . . . 1.8200000000000001 111.714 -177.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -60.64 -54.87 40.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.903 0.382 . . . . 1.99 110.101 176.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.1 tttp -71.98 -21.8 61.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.155 -0.475 . . . . 2.9300000000000002 111.495 -178.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.516 HG23 ' O ' ' A' ' 24' ' ' CYS . 72.9 t -59.64 -45.26 94.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 109.644 -0.502 . . . . 1.6299999999999999 109.644 174.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.12 -41.17 88.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.945 -0.571 . . . . 1.3300000000000001 110.102 175.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 68.7 mt-10 -53.76 -52.22 60.88 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.22 -0.446 . . . . 2.2000000000000002 111.037 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -75.43 -30.9 60.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.977 -0.556 . . . . 1.6699999999999999 110.919 -174.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.457 ' HZ3' ' CD ' ' A' ' 83' ' ' GLU . 55.0 tttm -60.68 -52.56 64.63 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.273 -0.421 . . . . 2.5299999999999998 110.718 -179.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -74.23 -26.03 60.01 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.847 -0.341 . . . . 1.24 110.699 178.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.4 t -67.49 -39.19 85.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.321 -0.399 . . . . 1.6599999999999999 110.413 179.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.0 m -71.33 -27.27 63.27 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.879 0.371 . . . . 0.79000000000000004 110.973 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.43 -45.22 10.72 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.188 0.44 . . . . 1.24 112.188 -175.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 86.3 mt -95.63 -21.96 17.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.676 0.274 . . . . 1.49 111.391 -176.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt 56.11 80.42 0.29 Allowed Pre-proline 0 C--N 1.329 -0.317 0 C-N-CA 123.399 0.68 . . . . 3.8500000000000001 112.116 -178.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.423 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 51.4 Cg_endo -92.92 138.98 1.64 Allowed 'Trans proline' 0 N--CA 1.446 -1.294 0 C-N-CA 122.938 2.425 . . . . 0.67000000000000004 111.684 171.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 13.5 p -75.7 -26.86 57.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.225 0.536 . . . . 1.3700000000000001 109.808 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.475 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 88.2 t80 -140.87 137.35 33.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.338 -0.846 . . . . 0.83999999999999997 109.757 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 48.4 tp -136.27 117.14 14.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.34 -0.391 . . . . 2.1899999999999999 110.338 178.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.456 ' HB2' ' CE2' ' A' ' 41' ' ' PHE . 40.5 tt0 -112.63 115.23 28.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.161 -0.472 . . . . 2.23 110.502 -178.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -94.28 117.12 29.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 2.23 110.101 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 57.2 t -120.37 127.9 75.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.113 -0.494 . . . . 1.72 111.08 -178.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -75.77 101.36 5.04 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.374 0.607 . . . . 1.8300000000000001 109.41 172.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.433 ' HE3' ' HB2' ' A' ' 47' ' ' LYS . 20.7 ttmt -101.74 21.67 14.11 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.57 -0.741 . . . . 3.2400000000000002 110.012 -175.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.534 ' HB3' ' HA2' ' A' ' 52' ' ' GLY . 22.9 t -94.62 134.7 36.92 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.554 -0.748 . . . . 3.3799999999999999 109.332 175.438 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.7 p -100.31 8.45 43.7 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.941 0.4 . . . . 5.1600000000000001 111.068 -178.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -122.82 -107.98 1.91 Allowed Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.498 -0.858 . . . . 3.3300000000000001 112.723 -178.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 62.4 m -88.5 1.71 54.31 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.078 0.399 . . . . 4.6299999999999999 112.078 -174.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.534 ' HA2' ' HB3' ' A' ' 48' ' ' SER . . . 80.12 44.69 8.74 Favored Glycine 0 N--CA 1.45 -0.369 0 N-CA-C 110.668 -0.973 . . . . 2.7599999999999998 110.668 -174.064 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.1 m -87.3 -6.32 58.57 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.08 -0.56 . . . . 3.98 111.554 -172.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.419 ' HA ' ' O ' ' A' ' 89' ' ' ALA . 26.6 p -138.73 137.61 36.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.994 0.426 . . . . 2.04 111.891 -175.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -111.57 135.97 51.42 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.913 -0.585 . . . . 1.3 109.533 174.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -119.27 118.38 31.1 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.449 -0.575 . . . . 1.3500000000000001 109.449 179.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -109.79 122.77 48.25 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.053 0.454 . . . . 1.23 111.767 -174.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 61.3 t -91.57 111.64 24.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.746 -0.661 . . . . 1.1799999999999999 109.265 174.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.462 ' CG1' ' HA ' ' A' ' 94' ' ' CYS . 1.4 pp -99.25 138.12 24.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.388 -0.369 . . . . 1.9399999999999999 110.358 -176.394 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.475 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 66.0 t -124.76 99.76 6.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 108.999 -0.741 . . . . 1.3700000000000001 108.999 174.437 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.423 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 31.4 t -139.25 148.19 42.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.053 0.454 . . . . 1.3100000000000001 111.8 -174.559 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.431 ' ND2' ' HG2' ' A' ' 97' ' ' PRO . 0.9 OUTLIER -67.66 -19.09 65.16 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.537 -0.756 . . . . 1.6699999999999999 111.033 174.164 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -56.1 -40.0 73.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.817 0.342 . . . . 1.8100000000000001 111.908 -175.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -94.25 5.24 52.38 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.942 0.349 . . . . 3.8700000000000001 111.942 -171.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.44 -14.6 60.86 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.873 -0.517 . . . . 2.1400000000000001 110.318 -178.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.537 ' OD2' ' HG2' ' A' ' 68' ' ' LYS . 23.1 t70 -81.27 -12.54 59.06 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.673 -0.694 . . . . 2.0299999999999998 109.793 174.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt 67.79 35.96 3.72 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.195 -0.911 . . . . 3.8599999999999999 110.731 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.869 ' HB3' ' HB2' ' A' ' 71' ' ' ASP . 32.2 mmtm -72.6 95.9 1.9 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.059 -0.519 . . . . 2.4900000000000002 111.225 177.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.421 ' O ' ' HG3' ' A' ' 72' ' ' ARG . 2.8 tm? -73.71 -47.32 40.36 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.759 -0.46 . . . . 2.8900000000000001 109.759 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.45 HD21 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.28 -32.09 72.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.275 -0.421 . . . . 1.6000000000000001 111.253 -177.966 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.869 ' HB2' ' HB3' ' A' ' 68' ' ' LYS . 3.6 m-20 -73.94 -42.52 60.42 Favored 'General case' 0 CA--C 1.52 -0.209 0 C-N-CA 120.976 -0.29 . . . . 2.0800000000000001 111.285 179.034 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.46 ' C ' ' HE ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -63.91 -28.32 69.75 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 120.128 -0.629 . . . . 3.4199999999999999 109.589 178.168 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 75.9 t60 -65.36 -58.88 4.79 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.19 -0.459 . . . . 1.3700000000000001 110.064 176.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.513 ' HD3' ' OD1' ' A' ' 71' ' ' ASP . 5.6 ptm180 -63.91 -41.6 97.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.019 -0.537 . . . . 2.1000000000000001 111.616 -175.099 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 89.2 mt -66.54 -51.39 57.08 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.631 0.253 . . . . 2.1299999999999999 110.866 -177.612 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.848 HG11 HD23 ' A' ' 80' ' ' LEU . 25.3 t -58.49 -44.94 90.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.439 . . . . 1.4099999999999999 111.171 -179.211 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.488 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 13.5 m120 -63.61 -43.11 97.86 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.714 -0.394 . . . . 1.21 111.277 -177.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 35.0 m -67.85 -40.99 83.61 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.138 0.422 . . . . 1.3200000000000001 112.138 -174.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.562 HG21 ' OE2' ' A' ' 83' ' ' GLU . 17.1 mt -90.07 -52.19 10.96 Favored 'Isoleucine or valine' 0 C--O 1.25 1.106 0 CA-C-O 122.011 0.91 . . . . 1.46 110.826 -175.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.848 HD23 HG11 ' A' ' 76' ' ' VAL . 9.7 mp -67.68 -9.85 47.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.352 -0.84 . . . . 1.3799999999999999 110.477 -179.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 55.5 tptt -47.07 -56.84 5.81 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 109.592 -0.522 . . . . 2.4199999999999999 109.592 165.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.544 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 43.7 mt-10 -74.99 -30.56 61.2 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.078 -0.51 . . . . 2.9100000000000001 111.253 -179.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.591 ' HB2' ' HA ' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -52.56 -56.09 17.69 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 122.353 1.073 . . . . 1.6599999999999999 110.91 173.764 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.767 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 32.9 mt -50.5 -30.69 13.43 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 112.94 -1.936 . . . . 1.27 112.906 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.544 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 26.1 mm-40 -59.12 -23.63 62.3 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 120.55 -0.46 . . . . 0.96999999999999997 110.54 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 -102.28 -23.23 14.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.126 -0.488 . . . . 1.02 111.154 -178.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.9 mt -110.3 133.87 54.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.757 0.313 . . . . 1.3100000000000001 111.03 -174.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 39.1 t60 -72.03 -43.34 65.13 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.853 0.359 . . . . 2.29 110.201 178.108 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.419 ' O ' ' HA ' ' A' ' 54' ' ' SER . . . -145.5 105.03 3.97 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.959 0.409 . . . . 1.3999999999999999 110.862 178.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -105.37 132.83 51.06 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.0 0.429 . . . . 0.63 110.672 176.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.9 m -123.77 145.96 48.66 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.921 -0.581 . . . . 1.9399999999999999 109.445 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -132.27 138.65 47.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.299 0.571 . . . . 1.27 111.499 -176.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -109.34 109.22 20.04 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.491 -0.777 . . . . 2.71 109.282 172.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.462 ' HA ' ' CG1' ' A' ' 59' ' ' ILE . 9.0 p -83.34 99.81 10.26 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.967 -0.561 . . . . 2.0 110.336 -176.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.5 m170 -118.45 163.01 17.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.452 0.644 . . . . 2.6099999999999999 111.423 -178.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.97 156.32 50.26 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 115.275 -0.875 . . . . 1.27 110.732 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.431 ' HG2' ' ND2' ' A' ' 62' ' ' ASN . 35.0 Cg_exo -58.63 -27.88 84.34 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.947 2.431 . . . . 1.0900000000000001 112.823 -177.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.51 -51.21 70.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.977 0.418 . . . . 2.6200000000000001 109.999 178.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.493 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 11.4 mp0 -65.6 -43.68 88.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.907 -0.588 . . . . 2.6899999999999999 110.666 178.164 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.421 ' O ' ' HG2' ' A' ' 104' ' ' LYS . 66.9 t80 -59.43 -37.39 77.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.095 -0.502 . . . . 1.6100000000000001 110.938 -179.326 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -57.9 -34.59 69.99 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.298 0.571 . . . . 1.23 110.503 178.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.64 ' HE2' ' N ' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -78.89 -44.97 21.59 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.5 -0.773 . . . . 3.1499999999999999 110.466 176.678 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.608 HD21 ' HA2' ' A' ' 107' ' ' GLY . 86.4 mt -60.37 -44.37 95.67 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.032 -0.531 . . . . 1.5900000000000001 111.894 -176.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 100' ' ' TYR . 4.4 pttp -63.53 -29.64 70.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.021 0.439 . . . . 2.3199999999999998 111.088 -179.25 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 21.7 t -83.13 -49.01 9.93 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.123 0.487 . . . . 2.21 109.916 -178.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -153.17 -44.38 0.1 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.655 -0.702 . . . . 4.4400000000000004 111.406 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.608 ' HA2' HD21 ' A' ' 103' ' ' LEU . . . 93.95 28.18 11.38 Favored Glycine 0 C--N 1.318 -0.423 0 N-CA-C 111.275 -0.73 . . . . 3.9199999999999999 111.275 -176.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 8.4 t . . . . . 0 C--O 1.252 1.208 0 CA-C-O 118.621 -0.705 . . . . 4.9800000000000004 109.266 -176.74 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.8 ptp . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 110.355 -0.239 . . . . 36.359999999999999 110.355 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 140.27 -170.97 24.15 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.925 -0.655 . . . . 33.770000000000003 112.021 179.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 69.6 m -87.9 156.22 19.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.853 0.359 . . . . 32.670000000000002 110.496 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 7.5 t -81.61 72.37 8.65 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.334 0.588 . . . . 30.75 110.079 -178.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 25.5 m170 -129.25 27.32 5.36 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.654 -0.703 . . . . 28.739999999999998 110.591 178.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -81.58 30.68 0.35 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.168 -0.469 . . . . 29.030000000000001 111.539 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -84.77 89.92 7.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.317 -0.401 . . . . 26.800000000000001 110.35 -178.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 14.6 p-80 -129.69 139.71 51.29 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.156 -0.475 . . . . 24.5 110.14 177.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 30.8 t60 -108.48 120.95 43.9 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.108 -0.496 . . . . 24.210000000000001 110.946 -173.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.2 t-160 -97.04 95.84 8.07 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.079 -0.711 . . . . 20.899999999999999 109.079 176.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.4 p -83.3 -60.41 2.15 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.03 -0.532 . . . . 20.109999999999999 112.231 -174.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.2 t -81.28 108.64 15.08 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.941 0.4 . . . . 17.379999999999999 110.995 -177.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -151.67 10.61 0.7 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.933 -0.651 . . . . 16.75 112.373 176.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -98.74 -26.04 14.47 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.006 0.432 . . . . 19.629999999999999 110.957 -177.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -120.5 22.95 11.07 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.211 -0.45 . . . . 14.57 111.774 -170.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -75.24 -1.16 22.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.39 -0.368 . . . . 16.100000000000001 110.876 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 82.4 mt -82.95 -18.02 41.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.139 -0.482 . . . . 16.719999999999999 110.564 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -101.44 110.07 22.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.048 -0.524 . . . . 15.609999999999999 110.22 -178.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.603 ' HA ' ' NE2' ' A' ' 22' ' ' HIS . 53.8 p90 -67.58 -24.38 65.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.988 -0.551 . . . . 11.970000000000001 110.879 -177.535 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -59.87 -23.83 63.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.617 -0.719 . . . . 10.890000000000001 112.006 -176.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -96.52 18.94 56.58 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.777 -0.725 . . . . 7.0 113.389 -175.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.603 ' NE2' ' HA ' ' A' ' 19' ' ' PHE . 29.0 p80 -159.06 64.37 0.41 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.397 0.618 . . . . 6.5999999999999996 111.216 177.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 88.4 mmm -88.56 -10.18 49.69 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.079 -0.509 . . . . 4.7999999999999998 110.876 -177.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 67.8 m -89.92 88.75 7.44 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.15 0.5 . . . . 2.2000000000000002 111.236 -179.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 11.9 tt -67.15 -35.87 75.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.914 -0.584 . . . . 1.8200000000000001 111.325 -177.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -62.12 -36.62 82.31 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 120.743 -0.383 . . . . 1.99 110.128 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.7 tppt? -65.63 -44.66 85.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.382 -0.372 . . . . 2.9300000000000002 110.489 178.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.0 t -54.59 -54.31 23.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 CA-C-O 120.865 0.364 . . . . 1.6299999999999999 110.93 178.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.431 HG13 ' OE1' ' A' ' 83' ' ' GLU . 1.8 mp -61.88 -54.64 31.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.029 -0.532 . . . . 1.3300000000000001 110.992 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -55.41 -52.44 63.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.025 -0.534 . . . . 2.2000000000000002 111.801 -174.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.04 -28.54 60.46 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.675 -0.41 . . . . 1.6699999999999999 111.381 -170.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.456 ' HZ3' ' CD ' ' A' ' 83' ' ' GLU . 8.1 ttpm? -67.95 -48.13 66.74 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.615 -0.434 . . . . 2.5299999999999998 110.665 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 pp -72.99 -29.64 63.2 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.781 -0.368 . . . . 1.24 110.944 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.0 m -70.44 -34.8 72.88 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 116.574 -0.284 . . . . 1.6599999999999999 111.058 178.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 56.4 m -71.59 -27.4 63.1 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.786 0.327 . . . . 0.79000000000000004 111.2 177.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.7 -49.68 15.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.282 -0.417 . . . . 1.24 111.739 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 91.0 mt -84.15 -31.66 25.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.859 0.361 . . . . 1.49 110.401 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.454 ' HA ' ' HD2' ' A' ' 38' ' ' LYS . 41.5 tptt 55.57 88.46 0.12 Allowed Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 114.959 -1.019 . . . . 3.8500000000000001 111.695 -176.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.929 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 97.4 Cg_endo -89.18 137.87 3.21 Favored 'Trans proline' 0 N--CA 1.451 -0.997 0 C-N-CA 122.743 2.295 . . . . 0.67000000000000004 112.606 179.188 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.4 p -69.91 -29.85 67.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.452 0.644 . . . . 1.3700000000000001 109.735 173.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.77 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 90.8 t80 -140.74 127.94 20.96 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.173 -0.921 . . . . 0.83999999999999997 109.112 175.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -136.28 126.05 25.62 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.518 -0.549 . . . . 2.1899999999999999 109.518 -178.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -129.64 127.84 41.41 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.735 -0.468 . . . . 2.23 109.735 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -94.99 115.75 27.83 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.78 -0.452 . . . . 2.23 109.78 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 60.8 t -103.44 121.76 55.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-N 116.041 -0.527 . . . . 1.72 110.395 -177.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -68.48 111.15 4.52 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.981 -0.554 . . . . 1.8300000000000001 109.667 177.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.698 ' HD3' ' HB2' ' A' ' 56' ' ' ASP . 18.5 tptt -81.08 117.39 21.62 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 108.883 -0.784 . . . . 3.2400000000000002 108.883 179.641 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.6 t -59.9 114.27 2.72 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.598 -0.728 . . . . 3.3799999999999999 112.063 -169.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 25.4 p -162.19 154.01 18.74 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.438 -0.801 . . . . 5.1600000000000001 109.356 173.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -73.83 -66.06 2.07 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.863 -0.684 . . . . 3.3300000000000001 113.385 -175.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 11.9 p -120.58 14.07 11.79 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.187 0.518 . . . . 4.6299999999999999 110.757 -176.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -76.74 -41.14 24.61 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.752 -0.737 . . . . 2.7599999999999998 112.454 -178.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 28.6 m 60.36 82.59 0.16 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.412 0.625 . . . . 3.98 110.41 -176.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.443 ' HG ' ' HB3' ' A' ' 47' ' ' LYS . 12.3 p -129.27 140.75 51.32 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.795 -0.639 . . . . 2.04 110.963 -177.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -127.4 133.53 49.99 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.323 -0.398 . . . . 1.3 110.818 -178.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.698 ' HB2' ' HD3' ' A' ' 47' ' ' LYS . 27.7 t0 -112.34 115.67 29.13 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.697 -0.853 . . . . 1.3500000000000001 108.697 177.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.85 119.53 39.39 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.208 0.528 . . . . 1.23 111.738 -171.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 48.4 t -84.27 111.32 19.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.646 -0.706 . . . . 1.1799999999999999 109.33 176.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.488 HG21 ' HA ' ' A' ' 94' ' ' CYS . 0.0 OUTLIER -107.52 109.29 27.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.712 0.767 . . . . 1.9399999999999999 110.45 -176.818 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.77 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 97.3 t -106.88 108.66 25.72 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 114.929 -1.032 . . . . 1.3700000000000001 109.024 175.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.929 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 31.2 t -153.38 155.08 35.74 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.064 0.459 . . . . 1.3100000000000001 111.935 -172.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.531 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 14.0 m120 -62.55 -19.44 63.67 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.409 -0.814 . . . . 1.6699999999999999 110.476 173.038 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -49.73 -46.62 50.52 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.775 -0.648 . . . . 1.8100000000000001 111.307 176.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -94.17 2.5 55.94 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.898 -0.592 . . . . 3.8700000000000001 110.812 -175.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.531 ' HB3' ' HA ' ' A' ' 62' ' ' ASN . 0.2 OUTLIER -85.25 -24.58 27.72 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-O 121.4 0.619 . . . . 2.1400000000000001 109.527 -176.51 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -77.2 1.38 18.6 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.739 -0.664 . . . . 2.0299999999999998 110.496 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 87.3 mttt 68.8 11.05 8.22 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.344 -0.844 . . . . 3.8599999999999999 112.7 175.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.6 mmmm -84.51 89.43 7.43 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.155 -0.618 . . . . 2.4900000000000002 110.229 -178.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.5 HD13 ' N ' ' A' ' 70' ' ' LEU . 3.3 pp -73.77 -34.25 64.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.033 -0.531 . . . . 2.8900000000000001 111.082 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.5 ' N ' HD13 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -68.0 -33.88 75.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.336 -0.393 . . . . 1.6000000000000001 111.036 178.387 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.659 ' O ' ' HG2' ' A' ' 74' ' ' ARG . 27.3 m-20 -74.03 -46.17 45.08 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.169 -0.213 . . . . 2.0800000000000001 111.153 -178.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.458 ' HG2' ' HA ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -61.07 -34.51 75.01 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.21 -0.596 . . . . 3.4199999999999999 109.918 176.84 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -64.44 -50.67 66.66 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.275 -0.421 . . . . 1.3700000000000001 110.163 179.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.659 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 4.4 ptm180 -66.15 -36.25 82.62 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.218 -0.446 . . . . 2.1000000000000001 110.944 -177.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 92.4 mt -66.94 -53.32 32.97 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.712 0.292 . . . . 2.1299999999999999 110.659 178.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.614 HG12 HD22 ' A' ' 80' ' ' LEU . 54.9 t -58.18 -44.18 87.19 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 CA-C-N 116.029 -0.532 . . . . 1.4099999999999999 110.895 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.54 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -62.3 -42.03 99.01 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.637 0.236 . . . . 1.21 111.637 -178.655 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 47.2 m -69.15 -48.91 61.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.923 0.392 . . . . 1.3200000000000001 111.577 -175.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 39.6 mt -75.49 -50.76 22.85 Favored 'Isoleucine or valine' 0 C--O 1.239 0.549 0 CA-C-O 121.522 0.677 . . . . 1.46 110.663 -177.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.889 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 9.6 mp -76.61 -5.36 47.42 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-N 115.631 -0.713 . . . . 1.3799999999999999 111.377 -175.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.54 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 18.7 tppt? -52.39 -63.63 1.08 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.559 -0.534 . . . . 2.4199999999999999 109.559 172.296 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -75.36 -30.71 60.29 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.758 -0.655 . . . . 2.9100000000000001 110.963 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.889 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 5.0 tp10 -55.96 -54.36 45.68 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.003 0.43 . . . . 1.6599999999999999 111.539 178.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.762 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 68.7 mt -50.69 -30.42 13.69 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-N 115.388 -0.824 . . . . 1.27 112.494 -178.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 -54.54 -28.29 44.51 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.629 0.252 . . . . 0.96999999999999997 111.362 -176.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -92.35 0.81 57.47 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.031 0.443 . . . . 1.02 110.951 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.503 HG22 ' HB2' ' A' ' 90' ' ' PHE . 9.5 mt -121.73 143.21 35.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.121 -0.491 . . . . 1.3100000000000001 109.847 -177.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 37.3 t60 -77.85 -46.06 22.51 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.699 -0.482 . . . . 2.29 109.699 176.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -153.77 102.74 2.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.07 -0.514 . . . . 1.3999999999999999 110.982 178.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . 0.503 ' HB2' HG22 ' A' ' 87' ' ' ILE . 83.2 t80 -102.33 131.84 48.69 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.278 -0.419 . . . . 0.63 110.24 175.523 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 31.6 t -122.37 157.53 31.62 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.502 -0.555 . . . . 1.9399999999999999 109.502 178.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -144.43 139.96 28.69 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.078 0.466 . . . . 1.27 110.958 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 26.5 mmtp -121.22 109.13 14.59 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.66 -0.7 . . . . 2.71 109.143 177.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.488 ' HA ' HG21 ' A' ' 59' ' ' ILE . 7.4 p -98.79 131.04 45.22 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.167 0.508 . . . . 2.0 112.23 -172.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.413 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 1.5 m170 -148.75 175.52 11.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.599 -0.728 . . . . 2.6099999999999999 110.223 174.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.401 ' HB ' ' HD2' ' A' ' 97' ' ' PRO . 74.9 p -103.25 159.24 29.9 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.293 -0.412 . . . . 1.27 111.229 -175.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.401 ' HD2' ' HB ' ' A' ' 96' ' ' THR . 20.4 Cg_endo -61.81 -26.41 79.44 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.634 2.222 . . . . 1.0900000000000001 111.667 176.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.65 -48.94 75.19 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.417 -0.586 . . . . 2.6200000000000001 109.417 178.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.545 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 11.4 mm-40 -61.24 -49.61 76.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.671 -0.695 . . . . 2.6899999999999999 110.597 177.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.547 ' O ' ' HG2' ' A' ' 104' ' ' LYS . 84.5 t80 -59.57 -42.88 93.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.856 -0.611 . . . . 1.6100000000000001 110.882 -178.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -61.48 -37.69 84.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 1.23 110.842 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.796 ' HA ' ' HE3' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -65.18 -38.35 90.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.412 -0.358 . . . . 3.1499999999999999 110.998 177.247 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 54.3 mt -66.04 -49.96 65.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.041 -0.527 . . . . 1.5900000000000001 110.67 -179.482 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.547 ' HG2' ' O ' ' A' ' 100' ' ' TYR . 16.8 ptmt -70.86 -29.63 65.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.158 -0.473 . . . . 2.3199999999999998 111.582 -178.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 25.2 t -60.0 -55.9 28.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.948 0.404 . . . . 2.21 111.167 -177.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.562 ' HZ1' ' HB2' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -121.54 -56.54 1.88 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.425 -0.352 . . . . 4.4400000000000004 111.84 -176.626 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 129.95 53.0 0.1 Allowed Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.704 -0.76 . . . . 3.9199999999999999 111.941 -176.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 5.0 p . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.469 -0.777 . . . . 4.9800000000000004 110.179 177.073 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.463 ' H1 ' ' CD ' ' A' ' 30' ' ' GLU . 96.0 mmm . . . . . 0 N--CA 1.481 1.108 0 N-CA-C 110.184 -0.302 . . . . 36.359999999999999 110.184 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 92.09 154.78 31.22 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.871 -0.681 . . . . 33.770000000000003 111.772 -177.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 25.4 t -87.84 110.44 20.5 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.609 -0.515 . . . . 32.670000000000002 109.609 178.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.501 ' OG ' ' HD2' ' A' ' 39' ' ' PRO . 3.6 m -55.28 114.24 1.72 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.759 -0.655 . . . . 30.75 112.54 -174.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 70.7 m80 -139.2 90.96 2.47 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.91 -0.774 . . . . 28.739999999999998 108.91 174.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 58.2 t60 -108.65 98.27 7.81 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.257 0.551 . . . . 29.030000000000001 112.386 -169.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 19.8 m80 -125.14 79.44 1.8 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.741 -0.837 . . . . 26.800000000000001 108.741 167.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 69.43 -46.84 0.58 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 114.925 -1.034 . . . . 24.5 110.858 -171.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 77.8 t60 -65.78 144.33 56.94 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.186 -0.461 . . . . 24.210000000000001 110.162 177.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 66.2 m-70 -81.8 -179.97 7.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.294 -0.412 . . . . 20.899999999999999 110.363 177.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.6 m -96.49 20.54 10.48 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.767 0.794 . . . . 20.109999999999999 109.461 178.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.7 m -114.99 158.18 22.41 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.983 -1.008 . . . . 17.379999999999999 110.751 -177.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 142.0 40.08 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.732 -0.746 . . . . 16.75 112.098 -179.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 53.9 mtm180 -112.75 -35.98 5.32 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.699 0.761 . . . . 19.629999999999999 109.733 -179.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.483 ' HB2' ' HB2' ' A' ' 20' ' ' GLN . 1.6 pm0 -86.29 17.34 3.76 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.861 -1.063 . . . . 14.57 111.485 -176.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -80.41 -12.36 59.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.117 0.484 . . . . 16.100000000000001 109.883 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 55.0 mt -75.33 -26.62 58.77 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.492 -0.776 . . . . 16.719999999999999 110.624 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.431 ' HB2' ' HG2' ' A' ' 20' ' ' GLN . 93.6 m-85 -115.48 178.03 4.45 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.696 -0.684 . . . . 15.609999999999999 110.548 -176.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.0 p90 -79.93 16.19 1.25 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.115 -0.493 . . . . 11.970000000000001 110.816 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.483 ' HB2' ' HB2' ' A' ' 15' ' ' GLU . 32.5 mm-40 -55.91 -78.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.768 -0.651 . . . . 10.890000000000001 112.016 -176.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 52.62 33.32 41.13 Favored Glycine 0 CA--C 1.52 0.368 0 C-N-CA 120.988 -0.625 . . . . 7.0 112.018 -175.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -77.74 82.73 4.12 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.449 0.643 . . . . 6.5999999999999996 112.029 -174.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 73.2 mtm -89.26 56.08 3.52 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.997 -0.547 . . . . 4.7999999999999998 109.774 175.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.459 ' O ' HG21 ' A' ' 28' ' ' VAL . 41.1 t -68.73 152.17 45.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.645 -0.707 . . . . 2.2000000000000002 110.032 178.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 10.3 tp -54.08 -31.15 21.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.045 -0.525 . . . . 1.8200000000000001 111.244 -178.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -59.38 -52.35 65.99 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.033 -0.53 . . . . 1.99 110.449 177.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -71.92 -29.64 64.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.818 -0.628 . . . . 2.9300000000000002 111.116 -177.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.459 HG21 ' O ' ' A' ' 24' ' ' CYS . 87.1 t -56.94 -50.21 76.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.838 0.351 . . . . 1.6299999999999999 110.392 177.397 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.68 HG23 ' HG3' ' A' ' 83' ' ' GLU . 1.7 mp -66.68 -39.85 84.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.972 -0.558 . . . . 1.3300000000000001 110.546 177.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.463 ' CD ' ' H1 ' ' A' ' 1' ' ' MET . 1.1 tm-20 -59.14 -52.19 66.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.95 -0.568 . . . . 2.2000000000000002 110.89 -177.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -67.24 -36.55 81.88 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.108 0.48 . . . . 1.6699999999999999 110.494 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 53.4 tttm -64.46 -52.57 57.32 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.592 -0.731 . . . . 2.5299999999999998 111.592 -176.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.428 HD11 ' N ' ' A' ' 34' ' ' SER . 4.6 pp -71.51 -28.45 63.91 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.753 -0.379 . . . . 1.24 110.549 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.428 ' N ' HD11 ' A' ' 33' ' ' LEU . 39.4 t -63.74 -45.2 90.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.094 0.473 . . . . 1.6599999999999999 110.024 177.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.0 m -62.16 -27.41 68.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.789 -0.641 . . . . 0.79000000000000004 111.926 -178.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -93.35 -54.67 3.59 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.031 0.382 . . . . 1.24 112.031 -177.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 96.5 mt -72.47 -30.83 64.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.373 -0.376 . . . . 1.49 111.335 -175.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm 61.12 68.07 1.31 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.871 -0.604 . . . . 3.8500000000000001 111.45 -178.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.517 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 72.6 Cg_endo -90.32 126.92 1.36 Allowed 'Trans proline' 0 N--CA 1.447 -1.245 0 C-N-CA 122.549 2.166 . . . . 0.67000000000000004 111.824 173.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.9 p -64.53 -26.36 68.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.301 0.572 . . . . 1.3700000000000001 110.191 177.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.53 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 77.9 t80 -141.78 140.22 32.98 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.373 -0.83 . . . . 0.83999999999999997 109.319 173.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -142.15 108.76 5.35 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.898 -0.778 . . . . 2.1899999999999999 108.898 179.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.521 ' HB3' ' HB ' ' A' ' 58' ' ' VAL . 27.1 tt0 -100.14 140.36 34.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.402 -0.363 . . . . 2.23 110.104 -178.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -107.45 120.39 42.05 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.09 0.472 . . . . 2.23 110.862 -179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 40.8 t -109.85 125.56 67.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 108.864 -0.791 . . . . 1.72 108.864 172.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -69.92 113.52 7.22 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.002 0.429 . . . . 1.8300000000000001 109.908 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.427 ' O ' ' HB2' ' A' ' 54' ' ' SER . 0.7 OUTLIER -91.85 78.94 5.35 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.109 -0.496 . . . . 3.2400000000000002 110.394 -176.368 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 38.6 m -68.94 90.45 0.44 Allowed 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.56 -0.533 . . . . 3.3799999999999999 109.56 174.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 9.6 t -99.4 3.1 45.73 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.991 -0.55 . . . . 5.1600000000000001 110.414 -176.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 79.92 -51.15 4.03 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.99 -0.624 . . . . 3.3300000000000001 113.055 175.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 34.2 m -54.9 -57.78 10.24 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 122.414 0.286 . . . . 4.6299999999999999 110.955 -178.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -164.96 -177.11 37.24 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 121.008 -0.615 . . . . 2.7599999999999998 111.592 -179.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.3 t -56.94 122.26 11.86 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.713 0.768 . . . . 3.98 111.121 -178.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' ' 47' ' ' LYS . 14.6 m -142.09 151.83 42.71 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.517 -0.765 . . . . 2.04 109.808 -178.361 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -135.14 141.37 45.95 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.654 -0.248 . . . . 1.3 110.502 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.68 108.44 17.49 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.455 -0.943 . . . . 1.3500000000000001 108.455 174.492 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.78 118.54 36.84 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.996 0.427 . . . . 1.23 111.525 -173.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.521 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 32.2 t -83.59 112.5 21.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.538 -0.541 . . . . 1.1799999999999999 109.538 177.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.49 HG12 ' HA ' ' A' ' 94' ' ' CYS . 2.8 pt -96.87 145.29 9.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.178 0.513 . . . . 1.9399999999999999 110.675 -177.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.53 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 60.8 t -137.86 97.56 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 N-CA-C 108.028 -1.101 . . . . 1.3700000000000001 108.028 174.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.517 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 40.8 t -144.61 150.66 37.81 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.04 0.756 . . . . 1.3100000000000001 113.04 -170.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.67 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 1.0 OUTLIER -67.22 -19.19 65.5 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 114.818 -1.083 . . . . 1.6699999999999999 110.886 172.939 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -55.55 -32.93 63.38 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.291 0.478 . . . . 1.8100000000000001 112.291 -172.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -104.35 -3.07 24.62 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.191 0.441 . . . . 3.8700000000000001 112.191 -173.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.67 ' HG2' ' O ' ' A' ' 62' ' ' ASN . 9.6 pt-20 -76.73 0.4 20.61 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.906 -0.496 . . . . 2.1400000000000001 111.15 -177.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.449 ' OD2' ' HG3' ' A' ' 68' ' ' LYS . 26.6 t70 -88.98 -8.71 53.59 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.064 0.459 . . . . 2.0299999999999998 110.061 177.146 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt 77.32 -13.82 0.91 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 115.244 -0.889 . . . . 3.8599999999999999 112.887 174.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.449 ' HG3' ' OD2' ' A' ' 66' ' ' ASP . 29.9 mtmm -72.28 111.85 7.85 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.961 0.41 . . . . 2.4900000000000002 110.971 176.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.4 pp -73.87 -31.41 63.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.796 -0.638 . . . . 2.8900000000000001 111.738 -176.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.424 ' C ' HD21 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -65.9 -31.1 71.85 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.677 -0.409 . . . . 1.6000000000000001 111.335 -175.002 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.525 ' O ' ' HG2' ' A' ' 74' ' ' ARG . 1.5 t70 -73.88 -37.13 64.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.248 0.547 . . . . 2.0800000000000001 109.969 -178.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.3 tmm_? -63.66 -44.14 94.66 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.967 -0.753 . . . . 3.4199999999999999 108.967 174.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 21.1 t60 -61.48 -50.25 73.51 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.243 -0.889 . . . . 1.3700000000000001 111.272 -178.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.525 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 9.3 ptm180 -62.0 -38.6 89.26 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.5 -0.318 . . . . 2.1000000000000001 111.192 -177.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -67.4 -54.18 22.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.973 0.416 . . . . 2.1299999999999999 110.633 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.841 HG12 HD22 ' A' ' 80' ' ' LEU . 65.2 t -58.86 -48.67 85.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.062 -0.517 . . . . 1.4099999999999999 111.237 -177.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.476 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -59.37 -48.23 82.42 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 121.161 -0.216 . . . . 1.21 111.464 -177.176 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 58.7 m -62.45 -54.77 35.23 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.813 0.671 . . . . 1.3200000000000001 112.813 -173.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.628 HG22 ' OE2' ' A' ' 83' ' ' GLU . 5.1 mp -85.08 -48.38 16.44 Favored 'Isoleucine or valine' 0 C--O 1.247 0.947 0 CA-C-O 121.545 0.688 . . . . 1.46 111.103 -174.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.841 HD22 HG12 ' A' ' 76' ' ' VAL . 8.1 mp -68.51 -10.32 54.85 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.972 -0.558 . . . . 1.3799999999999999 110.752 -177.151 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.476 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 20.7 tptm -52.01 -58.44 6.52 Favored 'General case' 0 C--N 1.333 -0.112 0 N-CA-C 109.493 -0.558 . . . . 2.4199999999999999 109.493 165.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.533 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 39.5 mt-10 -60.8 -36.43 79.02 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.331 -0.85 . . . . 2.9100000000000001 110.72 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.68 ' HG3' HG23 ' A' ' 29' ' ' ILE . 0.0 OUTLIER -52.76 -55.6 21.69 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 122.178 0.99 . . . . 1.6599999999999999 110.381 173.254 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.749 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 54.6 mt -50.25 -30.6 12.09 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 113.061 -1.881 . . . . 1.27 112.691 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.533 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 20.7 mm-40 -61.64 -25.6 67.47 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 120.909 0.385 . . . . 0.96999999999999997 110.736 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -98.35 -29.85 12.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.003 -0.544 . . . . 1.02 111.133 -176.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.477 HD11 ' HB2' ' A' ' 90' ' ' PHE . 2.7 mt -94.95 170.86 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 109.649 -0.5 . . . . 1.3100000000000001 109.649 -178.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -94.63 -59.34 1.95 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.199 -0.667 . . . . 2.29 109.199 169.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -133.71 111.27 10.43 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.765 -0.652 . . . . 1.3999999999999999 110.312 178.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . 0.477 ' HB2' HD11 ' A' ' 87' ' ' ILE . 90.2 t80 -95.21 122.51 37.97 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.112 0.482 . . . . 0.63 110.278 177.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 41.6 t -111.07 151.71 27.75 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.721 -0.672 . . . . 1.9399999999999999 109.381 178.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -140.27 145.29 37.11 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.913 0.387 . . . . 1.27 110.849 -177.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.471 ' HG3' HG21 ' A' ' 58' ' ' VAL . 61.9 mmtt -105.89 113.87 27.68 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.325 -0.991 . . . . 2.71 108.325 173.223 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.49 ' HA ' HG12 ' A' ' 59' ' ' ILE . 5.5 p -83.39 110.35 18.08 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.093 0.473 . . . . 2.0 111.087 -176.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -135.86 160.29 39.04 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.433 0.635 . . . . 2.6099999999999999 111.254 178.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.4 p -120.23 156.45 54.99 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.398 -0.819 . . . . 1.27 110.724 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -56.52 -52.12 7.71 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 123.259 2.639 . . . . 1.0900000000000001 114.393 -170.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -61.19 -47.37 86.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.79 0.328 . . . . 2.6200000000000001 111.398 -173.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 53.6 mp0 -68.14 -42.67 79.76 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.163 -0.471 . . . . 2.6899999999999999 111.105 -178.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -63.95 -33.42 75.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 1.6100000000000001 111.498 -176.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -62.8 -33.14 74.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.96 0.41 . . . . 1.23 111.147 -178.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.67 ' HE2' ' N ' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -75.17 -20.63 59.24 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.438 -0.346 . . . . 3.1499999999999999 110.684 179.478 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 83.5 mt -74.83 -53.04 9.83 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.84 -0.43 . . . . 1.5900000000000001 109.84 175.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 7.6 ptmt -68.64 -8.31 41.07 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.875 -0.602 . . . . 2.3199999999999998 111.472 179.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 47.8 t -56.81 -33.75 67.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.029 -0.532 . . . . 2.21 110.824 177.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.407 ' HG2' ' N ' ' A' ' 107' ' ' GLY . 0.0 OUTLIER -132.92 -45.99 0.86 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.034 0.445 . . . . 4.4400000000000004 110.7 177.83 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.407 ' N ' ' HG2' ' A' ' 106' ' ' LYS . . . 153.86 -42.63 0.62 Allowed Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 111.386 -0.686 . . . . 3.9199999999999999 111.386 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.449 -0.786 . . . . 4.9800000000000004 109.302 177.675 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.4 mtt . . . . . 0 N--CA 1.481 1.105 0 CA-C-O 120.731 0.301 . . . . 36.359999999999999 110.382 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 141.33 -170.05 24.83 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 111.296 -0.721 . . . . 33.770000000000003 111.296 -178.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 70.4 m -71.84 -52.24 18.43 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.955 0.378 . . . . 32.670000000000002 110.589 176.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 44.7 t -177.84 111.92 0.07 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.964 -0.562 . . . . 30.75 109.498 178.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.41 ' N ' ' HB3' ' A' ' 46' ' ' ASP . 78.6 m-70 -79.63 95.61 5.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.307 0.575 . . . . 28.739999999999998 111.267 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 45.0 m80 -84.92 110.21 18.7 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.744 -0.836 . . . . 29.030000000000001 108.744 175.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.3 p-80 -125.96 93.69 3.9 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.703 0.763 . . . . 26.800000000000001 111.259 -179.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 27.5 p80 -87.17 144.94 26.61 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.457 -0.792 . . . . 24.5 110.175 178.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 29.8 p-80 -159.32 176.22 12.42 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.135 -0.484 . . . . 24.210000000000001 110.195 -178.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -81.1 154.64 26.68 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.2 -0.667 . . . . 20.899999999999999 109.2 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.4 p -62.11 137.79 58.3 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.878 0.37 . . . . 20.109999999999999 111.495 -176.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.9 m -70.53 93.39 0.9 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.421 0.629 . . . . 17.379999999999999 110.678 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -137.66 44.12 1.15 Allowed Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 111.032 -0.827 . . . . 16.75 111.032 177.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 14' ' ' ARG . 11.3 ptm180 -129.41 -44.02 1.26 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.471 -0.364 . . . . 19.629999999999999 111.245 -177.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -102.97 4.77 37.79 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.218 0.532 . . . . 14.57 109.971 178.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.527 ' HB2' ' OG ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -59.32 -7.43 1.29 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 114.877 -1.056 . . . . 16.100000000000001 112.987 179.668 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.497 HD13 ' ND2' ' A' ' 16' ' ' ASN . 5.8 mp -82.08 -13.44 57.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.089 0.471 . . . . 16.719999999999999 110.203 175.465 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -123.93 98.05 5.63 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.133 -0.485 . . . . 15.609999999999999 110.173 -175.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -73.79 7.86 2.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.077 -0.51 . . . . 11.970000000000001 111.507 -176.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -89.32 16.37 7.55 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.076 -0.511 . . . . 10.890000000000001 111.037 178.164 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.424 ' C ' ' H ' ' A' ' 23' ' ' MET . . . -74.7 65.22 2.16 Favored Glycine 0 C--N 1.332 0.341 0 CA-C-N 116.157 -0.474 . . . . 7.0 113.045 -176.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -83.32 28.77 0.52 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.233 0.54 . . . . 6.5999999999999996 110.493 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.424 ' H ' ' C ' ' A' ' 21' ' ' GLY . 49.1 ttm -55.95 -38.76 70.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.129 -0.941 . . . . 4.7999999999999998 110.609 177.632 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.438 ' O ' HG23 ' A' ' 28' ' ' VAL . 43.0 t -163.78 146.48 9.66 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.916 -0.772 . . . . 2.2000000000000002 108.916 177.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 7.2 tp -55.85 -43.93 76.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 120.624 0.249 . . . . 1.8200000000000001 110.872 178.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -66.06 -35.68 81.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.97 0.414 . . . . 1.99 110.412 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -61.8 -39.32 91.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.819 -0.628 . . . . 2.9300000000000002 110.432 179.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 24' ' ' CYS . 65.3 t -60.82 -49.5 84.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.91 -0.586 . . . . 1.6299999999999999 110.254 178.164 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.438 HG13 ' CD ' ' A' ' 83' ' ' GLU . 1.7 mp -57.4 -49.75 79.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 116.089 -0.505 . . . . 1.3300000000000001 110.62 178.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 81.9 mt-10 -58.77 -51.97 67.69 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.231 -0.441 . . . . 2.2000000000000002 112.099 -176.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.433 ' OD1' ' HA ' ' A' ' 16' ' ' ASN . 16.1 t70 -70.16 -34.1 72.58 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.804 0.335 . . . . 1.6699999999999999 110.815 -174.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.405 ' HD2' ' OE2' ' A' ' 83' ' ' GLU . 37.6 ttmt -61.82 -48.86 78.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.269 -0.423 . . . . 2.5299999999999998 110.934 -178.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.6 pp -73.51 -26.22 60.79 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.887 -0.325 . . . . 1.24 110.629 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.404 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 67.0 m -72.37 -34.56 68.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.508 -0.314 . . . . 1.6599999999999999 110.628 178.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.527 ' OG ' ' HB2' ' A' ' 16' ' ' ASN . 67.2 m -67.16 -27.43 67.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.15 0.5 . . . . 0.79000000000000004 111.021 176.326 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.34 -54.82 3.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.095 -0.502 . . . . 1.24 111.843 -176.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.405 HD12 HG23 ' A' ' 76' ' ' VAL . 80.1 mt -84.06 -29.71 26.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.469 -0.332 . . . . 1.49 111.023 -175.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.3 tptm 55.84 78.38 0.38 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 115.454 -0.794 . . . . 3.8500000000000001 111.216 -176.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.594 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 83.6 Cg_endo -87.97 173.56 4.95 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 122.67 2.247 . . . . 0.67000000000000004 112.45 178.349 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.9 p -106.66 -27.61 10.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.141 0.496 . . . . 1.3700000000000001 110.287 175.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.493 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 86.2 t80 -136.63 138.57 41.3 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.825 -0.625 . . . . 0.83999999999999997 109.886 177.067 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 41.5 tp -142.21 116.45 9.5 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.255 -0.43 . . . . 2.1899999999999999 110.418 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -125.58 109.53 12.76 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.4 -0.364 . . . . 2.23 110.674 178.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.592 ' HG ' ' HB2' ' A' ' 57' ' ' ALA . 9.1 mp -94.87 123.58 38.42 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.394 -0.595 . . . . 2.23 109.394 173.056 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 86.1 t -103.33 133.2 47.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 115.974 -0.557 . . . . 1.72 110.489 -176.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.41 ' HB3' ' N ' ' A' ' 5' ' ' HIS . 3.3 t0 -64.11 110.08 2.05 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.711 -0.677 . . . . 1.8300000000000001 109.595 174.491 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.914 ' HD2' ' HB2' ' A' ' 56' ' ' ASP . 79.3 tttt -112.64 48.24 1.02 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.105 -0.952 . . . . 3.2400000000000002 109.706 -173.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 72.6 m -67.01 83.88 0.12 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.688 -0.687 . . . . 3.3799999999999999 111.063 177.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 20.1 t -79.35 94.19 5.46 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.296 -0.631 . . . . 5.1600000000000001 109.296 178.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 70.28 -114.27 5.37 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.774 -0.727 . . . . 3.3300000000000001 111.379 -173.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 66.8 m -113.8 107.48 15.78 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.256 -0.276 . . . . 4.6299999999999999 110.256 179.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 160.29 137.26 2.18 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.896 -0.668 . . . . 2.7599999999999998 112.204 179.44 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 13.7 m -83.77 99.02 10.02 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.037 0.446 . . . . 3.98 110.759 179.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.483 ' HB3' ' HB3' ' A' ' 89' ' ' ALA . 1.7 p -134.98 151.03 50.46 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.143 -0.48 . . . . 2.04 110.696 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -134.53 144.38 47.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.939 0.399 . . . . 1.3 111.372 -177.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.914 ' HB2' ' HD2' ' A' ' 47' ' ' LYS . 5.5 t70 -115.88 114.15 24.3 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.386 -0.968 . . . . 1.3500000000000001 108.386 174.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.592 ' HB2' ' HG ' ' A' ' 44' ' ' LEU . . . -110.63 126.54 54.59 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.436 0.532 . . . . 1.23 112.436 -171.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.4 t -93.08 119.84 41.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.601 -0.727 . . . . 1.1799999999999999 109.67 175.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.423 HD11 ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER -109.87 122.24 64.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 121.244 0.545 . . . . 1.9399999999999999 110.471 -178.56 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.493 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 89.8 t -114.45 107.82 23.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.596 -0.729 . . . . 1.3700000000000001 109.92 178.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.594 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 30.5 t -151.02 154.93 37.98 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.948 0.404 . . . . 1.3100000000000001 111.693 -174.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.482 ' ND2' ' HG2' ' A' ' 97' ' ' PRO . 1.0 OUTLIER -67.25 -18.86 65.4 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.744 -0.662 . . . . 1.6699999999999999 110.569 173.992 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -53.31 -24.19 11.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.258 -0.428 . . . . 1.8100000000000001 111.892 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -103.23 -8.31 20.49 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 111.994 0.368 . . . . 3.8700000000000001 111.994 -177.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -14.31 61.44 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.96 -0.463 . . . . 2.1400000000000001 110.988 -174.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -78.36 0.57 25.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.104 -0.498 . . . . 2.0299999999999998 110.545 -176.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 84.9 tttt 71.73 2.09 4.15 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.705 -0.679 . . . . 3.8599999999999999 111.174 176.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -80.28 89.62 5.51 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.046 0.45 . . . . 2.4900000000000002 110.272 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.8 tt -70.91 -49.03 50.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.857 -0.611 . . . . 2.8900000000000001 109.732 -179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.506 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -60.85 -33.25 72.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.85 -0.613 . . . . 1.6000000000000001 111.628 -179.557 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.506 ' N ' HD22 ' A' ' 70' ' ' LEU . 35.8 t70 -74.07 -48.06 32.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.931 0.396 . . . . 2.0800000000000001 110.293 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.15 -36.28 74.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.243 0.544 . . . . 3.4199999999999999 109.636 176.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 48.8 t60 -64.21 -54.8 27.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.505 -0.77 . . . . 1.3700000000000001 110.774 178.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.441 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 15.5 ptm180 -64.98 -40.39 94.91 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.004 0.372 . . . . 2.1000000000000001 112.004 -175.433 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 60.2 mt -60.22 -53.34 58.91 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.922 0.392 . . . . 2.1299999999999999 110.787 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.429 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 78.6 t -61.17 -43.59 96.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.922 -0.581 . . . . 1.4099999999999999 110.626 179.589 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.483 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -64.17 -35.88 82.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.279 -0.418 . . . . 1.21 112.078 -177.365 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 88.6 m -71.92 -44.39 63.72 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.775 0.322 . . . . 1.3200000000000001 111.335 -176.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.1 mt -76.84 -50.86 20.21 Favored 'Isoleucine or valine' 0 C--O 1.244 0.811 0 CA-C-O 121.769 0.795 . . . . 1.46 110.612 -178.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.76 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 10.5 mp -74.14 -9.29 58.47 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.356 -0.838 . . . . 1.3799999999999999 111.418 -176.38 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 16.2 tttm -53.88 -61.93 1.98 Allowed 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 109.778 -0.453 . . . . 2.4199999999999999 109.778 172.071 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.429 ' CD ' ' HZ1' ' A' ' 81' ' ' LYS . 0.4 OUTLIER -72.18 -30.07 64.61 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.689 -0.687 . . . . 2.9100000000000001 110.288 -178.074 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.662 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.5 tp10 -55.88 -47.52 77.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.334 -0.848 . . . . 1.6599999999999999 111.588 175.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.76 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 54.4 mt -49.96 -30.87 11.23 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 114.8 -1.091 . . . . 1.27 113.58 -178.259 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -55.54 -18.06 6.63 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.562 0.578 . . . . 0.96999999999999997 112.562 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -87.08 -8.19 57.31 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.749 0.309 . . . . 1.02 111.228 179.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.45 HD12 ' HB2' ' A' ' 90' ' ' PHE . 0.4 OUTLIER -133.27 175.87 10.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.885 -0.413 . . . . 1.3100000000000001 109.885 -177.588 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 14.4 p80 -116.28 -13.99 11.07 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.622 -0.431 . . . . 2.29 110.969 173.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.483 ' HB3' ' HB3' ' A' ' 54' ' ' SER . . . -162.15 105.94 1.18 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.919 0.39 . . . . 1.3999999999999999 111.418 -178.447 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . 0.45 ' HB2' HD12 ' A' ' 87' ' ' ILE . 91.2 t80 -132.17 122.04 24.66 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.919 -0.582 . . . . 0.63 110.046 175.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.4 p -116.54 144.8 43.9 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.712 0.291 . . . . 1.9399999999999999 110.721 179.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -123.38 145.95 48.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.945 0.402 . . . . 1.27 111.102 -178.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 26.4 mmtp -125.66 120.23 30.17 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.877 -0.786 . . . . 2.71 108.877 177.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.405 ' HA ' HG21 ' A' ' 59' ' ' ILE . 5.9 p -101.25 135.47 42.67 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.487 0.551 . . . . 2.0 112.487 -172.32 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 8.5 m80 -147.74 172.61 13.82 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.536 -0.756 . . . . 2.6099999999999999 109.473 174.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.449 ' HG1' ' CD ' ' A' ' 99' ' ' GLU . 0.3 OUTLIER -111.04 158.67 35.19 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-O 121.014 0.435 . . . . 1.27 111.843 -177.925 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.482 ' HG2' ' ND2' ' A' ' 62' ' ' ASN . 26.1 Cg_exo -62.25 -18.36 61.99 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.201 2.601 . . . . 1.0900000000000001 112.353 -177.549 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -59.63 -51.23 70.69 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.895 -0.593 . . . . 2.6200000000000001 109.989 174.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.449 ' CD ' ' HG1' ' A' ' 96' ' ' THR . 1.9 mp0 -60.97 -44.81 96.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.109 0.481 . . . . 2.6899999999999999 110.153 175.106 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.41 ' HB3' ' HA ' ' A' ' 97' ' ' PRO . 74.1 t80 -57.6 -41.24 80.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.367 -0.833 . . . . 1.6100000000000001 111.486 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -58.87 -39.47 81.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.421 -0.354 . . . . 1.23 111.646 -178.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.693 ' HE2' ' N ' ' A' ' 102' ' ' LYS . 0.8 OUTLIER -65.4 -37.68 87.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.817 0.341 . . . . 3.1499999999999999 110.222 179.363 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.571 ' HA ' ' HA2' ' A' ' 107' ' ' GLY . 69.8 mt -65.24 -49.86 68.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.703 -0.68 . . . . 1.5900000000000001 111.114 -179.025 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -35.28 78.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.469 -0.332 . . . . 2.3199999999999998 111.298 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 31.1 t -63.74 -50.54 68.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.691 0.281 . . . . 2.21 110.608 -178.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.13 -43.77 0.1 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.053 0.454 . . . . 4.4400000000000004 110.676 178.002 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.571 ' HA2' ' HA ' ' A' ' 103' ' ' LEU . . . 138.92 -35.51 1.98 Allowed Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.639 -0.71 . . . . 3.9199999999999999 111.575 178.862 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.9 t . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.494 -0.765 . . . . 4.9800000000000004 110.159 -179.067 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.8 ttp . . . . . 0 N--CA 1.478 0.948 0 CA-C-O 120.866 0.365 . . . . 36.359999999999999 110.401 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -171.65 -134.08 1.73 Allowed Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 121.055 -0.593 . . . . 33.770000000000003 111.846 178.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.9 m -110.32 153.53 24.76 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.744 0.307 . . . . 32.670000000000002 110.211 178.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.8 m -141.06 95.83 2.9 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.882 -0.414 . . . . 30.75 109.882 177.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -75.15 98.3 3.68 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.213 -0.662 . . . . 28.739999999999998 109.213 178.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.5 p-80 -78.44 132.0 37.12 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.1 -0.5 . . . . 29.030000000000001 111.857 -173.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.7 p-80 -114.32 143.03 45.54 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.577 -0.738 . . . . 26.800000000000001 109.304 177.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -170.3 118.33 0.55 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.641 0.258 . . . . 24.5 110.496 175.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 9.9 p-80 -153.17 123.72 7.21 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.125 0.488 . . . . 24.210000000000001 110.819 174.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 17.9 t60 -88.01 95.35 10.1 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.487 -0.931 . . . . 20.899999999999999 108.487 173.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.5 m -126.28 118.65 25.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.097 -0.501 . . . . 20.109999999999999 111.057 -172.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.9 p -120.53 110.76 16.85 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.21 -0.45 . . . . 17.379999999999999 110.605 179.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 130.78 74.62 0.13 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.586 -0.816 . . . . 16.75 112.84 178.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.02 -17.93 3.82 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.98 0.419 . . . . 19.629999999999999 111.389 177.773 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -87.49 7.11 30.82 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.529 -0.305 . . . . 14.57 111.451 -175.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -73.93 -12.78 60.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.929 0.395 . . . . 16.100000000000001 110.718 -178.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.2 mp -75.88 -14.65 60.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.063 -0.517 . . . . 16.719999999999999 110.69 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -100.9 125.4 47.45 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.18 -0.464 . . . . 15.609999999999999 110.029 -177.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.9 p90 -98.07 15.78 23.16 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.285 -0.416 . . . . 11.970000000000001 111.051 -175.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 65.32 35.72 7.4 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.905 -0.589 . . . . 10.890000000000001 110.349 179.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -58.46 -45.36 94.54 Favored Glycine 0 C--N 1.334 0.435 0 CA-C-N 115.631 -0.713 . . . . 7.0 112.432 -179.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -138.34 98.61 3.64 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.48 0.657 . . . . 6.5999999999999996 110.246 177.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 81.4 mmm -109.69 -45.92 3.59 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.93 -0.577 . . . . 4.7999999999999998 109.479 178.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 51.8 t -159.86 134.07 7.48 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.388 -0.824 . . . . 2.2000000000000002 109.512 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.496 HD13 ' HB3' ' A' ' 86' ' ' ASN . 9.6 tp -61.41 -32.88 54.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.832 0.349 . . . . 1.8200000000000001 110.899 -179.097 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -63.67 -38.9 92.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.266 -0.425 . . . . 1.99 110.186 178.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -67.16 -34.11 76.86 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.981 -0.554 . . . . 2.9300000000000002 110.694 177.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 71.3 t -59.0 -55.35 24.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.716 0.293 . . . . 1.6299999999999999 110.619 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.476 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 2.0 mp -63.91 -44.63 98.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.982 -0.554 . . . . 1.3300000000000001 110.455 178.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 34' ' ' SER . 21.0 tt0 -52.4 -51.12 60.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.849 -0.614 . . . . 2.2000000000000002 110.904 179.332 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -71.81 -38.07 70.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.446 -0.797 . . . . 1.6699999999999999 111.344 -173.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -60.19 -55.96 27.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.322 -0.399 . . . . 2.5299999999999998 111.583 -176.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 3.7 pp -74.1 -25.32 59.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.671 -0.241 . . . . 1.24 111.508 -178.799 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.447 ' N ' HD12 ' A' ' 33' ' ' LEU . 8.0 t -68.65 -36.76 79.0 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 121.044 -0.262 . . . . 1.6599999999999999 110.652 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.1 m -70.43 -27.49 64.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.762 0.315 . . . . 0.79000000000000004 110.946 178.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.427 ' CB ' HG12 ' A' ' 79' ' ' ILE . . . -85.25 -54.88 4.33 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.067 0.395 . . . . 1.24 112.067 -176.061 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.5 mt -85.09 -34.84 22.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.647 0.26 . . . . 1.49 110.839 -176.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.5 ttmt 58.92 84.78 0.2 Allowed Pre-proline 0 C--O 1.234 0.26 0 CA-C-N 115.391 -0.822 . . . . 3.8500000000000001 111.727 178.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.845 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 93.8 Cg_endo -93.77 161.27 2.28 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 123.073 2.516 . . . . 0.67000000000000004 112.72 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 32.7 p -89.4 -21.1 23.22 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.695 0.76 . . . . 1.3700000000000001 109.177 173.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.611 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 89.9 t80 -141.39 132.07 25.63 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.053 -0.976 . . . . 0.83999999999999997 109.47 175.079 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.5 tp -140.67 127.69 20.74 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.268 -0.423 . . . . 2.1899999999999999 110.249 -179.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -139.14 124.11 18.82 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.959 0.409 . . . . 2.23 110.609 177.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.8 mp -95.84 117.27 30.25 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.934 -0.575 . . . . 2.23 109.509 175.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 31.6 t -103.12 130.64 52.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.684 -0.689 . . . . 1.72 110.262 -176.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -79.34 101.42 8.08 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.819 -0.437 . . . . 1.8300000000000001 109.819 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -92.49 59.22 3.33 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.316 0.579 . . . . 3.2400000000000002 110.354 -175.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.611 ' HA ' ' O ' ' A' ' 51' ' ' CYS . 3.0 p -80.65 16.26 1.45 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.516 -0.766 . . . . 3.3799999999999999 111.914 -177.279 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 53.1 t -59.31 -42.27 91.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.08 -0.509 . . . . 5.1600000000000001 110.673 177.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -146.09 19.54 1.75 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.626 -0.797 . . . . 3.3300000000000001 112.187 179.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.611 ' O ' ' HA ' ' A' ' 48' ' ' SER . 75.3 m -148.78 152.79 37.17 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 110.31 -0.256 . . . . 4.6299999999999999 110.31 -178.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.52 ' C ' ' HG1' ' A' ' 53' ' ' THR . . . -120.77 152.74 16.78 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.87 -0.681 . . . . 2.7599999999999998 111.504 176.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.52 ' HG1' ' C ' ' A' ' 52' ' ' GLY . 9.3 p 48.98 43.52 21.99 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.167 0.587 . . . . 3.98 111.658 -179.381 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.4 m -146.39 136.79 23.87 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.631 -0.713 . . . . 2.04 109.834 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -121.64 161.56 22.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.995 0.426 . . . . 1.3 111.312 -174.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.419 ' HA ' ' O ' ' A' ' 91' ' ' SER . 12.7 t70 -118.15 127.23 53.57 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.252 -1.018 . . . . 1.3500000000000001 108.252 171.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.91 115.8 30.85 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.138 0.494 . . . . 1.23 111.602 -174.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.3 t -81.76 111.15 17.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.652 -0.704 . . . . 1.1799999999999999 109.194 174.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.449 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -106.56 114.34 45.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.188 0.518 . . . . 1.9399999999999999 110.049 -178.494 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.611 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 97.1 t -110.02 103.86 16.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.814 -0.63 . . . . 1.3700000000000001 109.976 178.054 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.845 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 46.2 t -154.55 149.38 26.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.152 0.501 . . . . 1.3100000000000001 111.171 -177.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.551 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 40.8 m-80 -67.3 -18.64 65.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.451 -0.795 . . . . 1.6699999999999999 111.176 176.035 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -47.97 -24.45 1.06 Allowed 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 112.369 0.507 . . . . 1.8100000000000001 112.369 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.5 ' HD1' ' HB2' ' A' ' 68' ' ' LYS . 76.9 m-85 -118.6 16.05 13.68 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 112.196 0.443 . . . . 3.8700000000000001 112.196 -178.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.551 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 1.0 OUTLIER -68.82 -15.85 63.62 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 120.795 0.331 . . . . 2.1400000000000001 111.734 -176.153 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.577 ' HB3' ' HD3' ' A' ' 68' ' ' LYS . 31.0 t70 -84.37 15.6 3.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.252 0.548 . . . . 2.0299999999999998 110.118 179.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.6 ' HZ1' ' HB2' ' A' ' 67' ' ' LYS . 10.6 mtmp? 57.62 51.02 10.03 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.616 -0.72 . . . . 3.8599999999999999 109.845 -175.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.869 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 31.2 mmmt -76.91 89.03 3.48 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.871 -0.604 . . . . 2.4900000000000002 110.436 -176.149 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.7 tt -73.66 -55.01 6.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.294 0.568 . . . . 2.8900000000000001 109.681 177.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.486 HD21 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.5 -31.43 71.56 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.418 -0.81 . . . . 1.6000000000000001 110.796 -178.341 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.869 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 25.5 t70 -73.68 -35.71 65.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.901 0.382 . . . . 2.0800000000000001 110.306 -178.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -39.4 93.55 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.317 -0.623 . . . . 3.4199999999999999 109.317 174.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 39.6 t60 -65.51 -51.35 60.6 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.895 -0.593 . . . . 1.3700000000000001 110.64 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.53 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 3.8 ptm180 -66.54 -48.19 70.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.311 -0.404 . . . . 2.1000000000000001 111.81 -176.121 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -61.39 -45.03 96.06 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.57 0.224 . . . . 2.1299999999999999 111.446 -177.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.736 HG12 HD22 ' A' ' 80' ' ' LEU . 41.9 t -59.99 -42.57 90.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.427 -0.351 . . . . 1.4099999999999999 110.732 178.18 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.62 -43.6 89.06 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.947 -0.301 . . . . 1.21 111.181 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 45.1 m -61.82 -55.92 24.93 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.988 0.366 . . . . 1.3200000000000001 111.988 -177.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.427 HG12 ' CB ' ' A' ' 36' ' ' ALA . 4.2 mp -78.5 -48.6 22.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 120.819 0.342 . . . . 1.46 111.416 -176.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.752 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.7 mp -73.48 -6.68 47.92 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 116.509 -0.314 . . . . 1.3799999999999999 111.741 -173.616 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -49.75 -54.59 18.09 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.335 -0.617 . . . . 2.4199999999999999 109.335 167.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.423 ' O ' ' HG2' ' A' ' 85' ' ' GLN . 36.6 tt0 -75.19 -40.27 59.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.467 -0.788 . . . . 2.9100000000000001 110.713 178.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.752 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.8 tp10 -53.71 -51.34 63.58 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.456 -0.793 . . . . 1.6599999999999999 112.025 -177.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.675 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 67.3 mt -50.31 -30.71 12.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.204 -0.907 . . . . 1.27 112.614 -177.089 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 17.6 mm-40 -52.24 -26.53 12.03 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 111.886 0.328 . . . . 0.96999999999999997 111.886 -176.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.496 ' HB3' HD13 ' A' ' 25' ' ' ILE . 29.8 m-80 -100.23 1.49 41.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.872 0.367 . . . . 1.02 111.209 -177.231 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.432 HD13 ' HG3' ' A' ' 83' ' ' GLU . 0.5 OUTLIER -130.56 175.9 9.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 110.007 -0.368 . . . . 1.3100000000000001 110.007 -175.552 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 56.1 m-70 -123.16 -73.85 0.63 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.314 0.578 . . . . 2.29 110.008 176.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -104.91 57.72 0.69 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.406 -0.816 . . . . 1.3999999999999999 110.505 -175.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -75.19 145.27 42.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.984 -0.553 . . . . 0.63 110.887 -177.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.419 ' O ' ' HA ' ' A' ' 56' ' ' ASP . 40.1 t -140.32 167.62 21.72 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.927 -0.579 . . . . 1.9399999999999999 109.513 178.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -148.58 149.88 32.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.713 0.292 . . . . 1.27 110.707 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -125.03 109.85 13.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.183 -0.462 . . . . 2.71 110.044 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.417 ' HA ' HG22 ' A' ' 59' ' ' ILE . 4.1 p -83.41 126.91 33.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.23 0.538 . . . . 2.0 111.713 -176.287 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.448 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 45.9 m80 -142.07 162.94 34.22 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.556 -0.747 . . . . 2.6099999999999999 110.038 178.274 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.5 p -112.56 154.61 44.6 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 116.524 -0.307 . . . . 1.27 110.963 176.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.49 ' HG2' ' ND2' ' A' ' 62' ' ' ASN . 35.8 Cg_exo -59.1 -26.69 82.62 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 123.031 2.487 . . . . 1.0900000000000001 112.522 -178.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -61.2 -46.43 90.48 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.872 -0.604 . . . . 2.6200000000000001 110.173 177.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -71.57 -41.07 69.49 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.802 -0.635 . . . . 2.6899999999999999 110.706 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -56.73 -40.94 76.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.906 -0.588 . . . . 1.6100000000000001 111.614 -178.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -58.1 -35.89 72.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.85 0.357 . . . . 1.23 111.043 -178.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.691 ' HE2' ' N ' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -74.18 -32.58 63.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.802 0.334 . . . . 3.1499999999999999 110.288 179.04 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 85.8 mt -69.05 -52.12 31.89 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.323 -0.399 . . . . 1.5900000000000001 110.54 179.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -68.32 -14.12 62.76 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.051 -0.522 . . . . 2.3199999999999998 111.598 -178.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 4.9 t -59.58 -34.06 72.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.064 0.459 . . . . 2.21 109.951 179.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.79 -42.55 3.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.071 -0.513 . . . . 4.4400000000000004 110.8 175.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 107.51 38.58 2.06 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.969 -0.634 . . . . 3.9199999999999999 111.631 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 42.2 p . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.859 -0.591 . . . . 4.9800000000000004 110.092 -178.744 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.6 mtp . . . . . 0 N--CA 1.482 1.161 0 N-CA-C 110.185 -0.302 . . . . 36.359999999999999 110.185 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -161.91 148.34 15.61 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.576 -0.821 . . . . 33.770000000000003 112.789 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.0 t -131.11 98.93 4.71 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.321 -0.622 . . . . 32.670000000000002 109.321 175.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.507 ' O ' ' HD2' ' A' ' 5' ' ' HIS . 41.2 m -67.53 135.81 53.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.011 -0.54 . . . . 30.75 111.79 -174.402 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.507 ' HD2' ' O ' ' A' ' 4' ' ' SER . 0.6 OUTLIER 31.94 45.98 0.05 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.351 1.46 . . . . 28.739999999999998 114.233 178.309 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.5 t-80 -95.83 4.93 52.42 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.938 0.399 . . . . 29.030000000000001 110.599 -178.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -105.13 22.67 14.93 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.993 0.425 . . . . 26.800000000000001 110.574 178.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.7 m170 -117.14 127.48 54.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.308 -0.405 . . . . 24.5 110.683 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 63.6 t-80 -176.16 118.82 0.14 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.851 -0.613 . . . . 24.210000000000001 109.481 177.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -156.94 171.77 19.86 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.818 0.342 . . . . 20.899999999999999 110.866 177.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.5 m -77.39 159.19 29.65 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.784 -0.644 . . . . 20.109999999999999 109.682 175.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.2 m 61.93 95.35 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.215 0.531 . . . . 17.379999999999999 111.381 -178.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -131.78 -61.09 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.905 -0.664 . . . . 16.75 112.88 -177.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.607 ' HD3' ' H ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -126.92 -8.92 6.03 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.174 0.512 . . . . 19.629999999999999 111.15 -174.847 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.778 ' HG3' ' HA ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -104.58 -16.87 14.9 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.682 -0.69 . . . . 14.57 110.246 -175.887 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.405 ' N ' HD21 ' A' ' 16' ' ' ASN . 0.1 OUTLIER -66.94 5.08 0.71 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.56 -0.746 . . . . 16.100000000000001 112.478 -179.067 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.6 mp -68.05 -26.59 65.94 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 109.799 -0.445 . . . . 16.719999999999999 109.799 174.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -83.87 89.05 7.14 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.845 -0.798 . . . . 15.609999999999999 108.845 174.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.454 ' CE2' ' HA3' ' A' ' 21' ' ' GLY . 21.6 p90 -94.23 19.44 9.38 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.912 -1.04 . . . . 11.970000000000001 111.552 -171.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.537 ' HG3' ' OE1' ' A' ' 30' ' ' GLU . 2.6 mp0 70.9 19.0 5.91 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.508 0.505 . . . . 10.890000000000001 111.209 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.454 ' HA3' ' CE2' ' A' ' 19' ' ' PHE . . . -90.97 -70.16 1.2 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.43 -0.89 . . . . 7.0 113.244 -177.018 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 28.9 t60 -68.43 133.95 49.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.7 0.286 . . . . 6.5999999999999996 110.893 -176.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.6 ttt -56.16 122.77 12.47 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.827 -0.624 . . . . 4.7999999999999998 110.909 177.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.4 t -149.66 160.9 43.13 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.47 -0.567 . . . . 2.2000000000000002 109.47 -177.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.49 HD13 ' HB3' ' A' ' 86' ' ' ASN . 8.6 tp -56.87 -35.82 47.92 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-O 120.886 0.374 . . . . 1.8200000000000001 110.291 176.409 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -58.4 -45.98 87.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.832 -0.622 . . . . 1.99 110.527 176.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.814 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -57.66 -42.85 84.33 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.85 -0.614 . . . . 2.9300000000000002 110.627 -178.869 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.517 ' O ' ' HG2' ' A' ' 32' ' ' LYS . 60.4 t -58.82 -49.98 81.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-N 116.023 -0.535 . . . . 1.6299999999999999 110.711 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.524 HD11 ' HB2' ' A' ' 86' ' ' ASN . 1.7 mp -58.8 -46.01 91.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.895 -0.593 . . . . 1.3300000000000001 110.243 178.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.537 ' OE1' ' HG3' ' A' ' 20' ' ' GLN . 62.2 mt-10 -53.33 -50.42 65.03 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.106 -0.497 . . . . 2.2000000000000002 111.037 177.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -60.03 -33.88 72.62 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.227 -0.442 . . . . 1.6699999999999999 111.853 -176.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.517 ' HG2' ' O ' ' A' ' 28' ' ' VAL . 14.8 mmmm -71.27 -55.65 7.63 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.858 -0.337 . . . . 2.5299999999999998 111.091 -178.105 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.489 HD11 ' N ' ' A' ' 34' ' ' SER . 4.1 pp -69.43 -28.55 66.23 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.9 0.333 . . . . 1.24 111.9 -176.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.489 ' N ' HD11 ' A' ' 33' ' ' LEU . 52.5 p -72.1 -33.29 67.74 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.876 -0.33 . . . . 1.6599999999999999 110.884 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 52.3 m -68.14 -34.84 77.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.916 0.388 . . . . 0.79000000000000004 110.755 178.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.28 -54.56 4.24 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.243 0.46 . . . . 1.24 112.243 -175.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.3 mt -81.6 -23.85 36.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.396 -0.365 . . . . 1.49 110.805 -175.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 64.3 mttp 49.28 69.19 2.84 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 115.579 -0.737 . . . . 3.8500000000000001 112.193 -179.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.592 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 71.5 Cg_endo -80.85 134.53 9.62 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.039 1.826 . . . . 0.67000000000000004 112.034 176.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 20.8 p -67.02 -30.72 70.88 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.091 0.472 . . . . 1.3700000000000001 110.045 177.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.579 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 81.3 t80 -140.43 139.16 35.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.811 -0.632 . . . . 0.83999999999999997 109.851 176.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 60.9 tp -135.1 121.69 20.69 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.339 -0.391 . . . . 2.1899999999999999 110.131 178.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -119.49 115.74 24.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.982 0.42 . . . . 2.23 110.517 179.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -91.26 115.64 28.19 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.06 -0.518 . . . . 2.23 109.735 178.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.778 ' HA ' ' HG3' ' A' ' 15' ' ' GLU . 40.4 t -114.41 142.44 27.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.498 0.666 . . . . 1.72 110.676 -178.219 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.56 123.92 23.53 Favored 'General case' 0 N--CA 1.438 -1.041 0 CA-C-N 114.957 -1.019 . . . . 1.8300000000000001 108.836 178.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 45.4 tttp -69.1 113.57 6.59 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.929 -0.578 . . . . 3.2400000000000002 111.335 -169.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.3 m -60.21 114.94 3.15 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.291 -0.868 . . . . 3.3799999999999999 111.428 -178.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 86.5 m 68.16 23.42 7.94 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.259 -0.882 . . . . 5.1600000000000001 111.402 177.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -71.72 122.73 9.44 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.473 -0.87 . . . . 3.3300000000000001 111.423 175.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 62.7 m -73.25 92.82 1.81 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.043 0.449 . . . . 4.6299999999999999 110.71 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 105.32 177.68 24.21 Favored Glycine 0 N--CA 1.443 -0.868 0 N-CA-C 111.462 -0.655 . . . . 2.7599999999999998 111.462 -177.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.542 ' O ' ' HB3' ' A' ' 88' ' ' HIS . 28.3 m -64.33 98.02 0.22 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.356 0.598 . . . . 3.98 110.299 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.495 ' HB3' ' HB2' ' A' ' 89' ' ' ALA . 4.2 p -128.14 138.82 52.66 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.64 -0.709 . . . . 2.04 110.571 -176.371 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -113.12 132.53 55.41 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.115 -0.493 . . . . 1.3 110.03 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -114.82 109.5 18.26 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.342 -0.984 . . . . 1.3500000000000001 108.342 175.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.99 120.06 40.79 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.256 0.55 . . . . 1.23 111.832 -170.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 59.0 t -79.26 114.21 19.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 115.35 -0.841 . . . . 1.1799999999999999 109.016 173.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.472 ' CG1' ' HA ' ' A' ' 94' ' ' CYS . 1.2 pp -96.73 136.19 28.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.719 -0.475 . . . . 1.9399999999999999 109.719 -177.498 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.579 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 90.0 t -130.81 97.9 3.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 108.772 -0.825 . . . . 1.3700000000000001 108.772 176.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.592 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 40.8 t -145.39 150.92 37.43 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.291 0.567 . . . . 1.3100000000000001 111.977 -173.151 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.685 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 15.7 m120 -67.96 -19.15 64.93 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.354 -0.839 . . . . 1.6699999999999999 110.178 172.029 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -62.57 -9.07 7.6 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.013 0.435 . . . . 1.8100000000000001 111.325 -178.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -116.34 -11.83 11.18 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.125 0.417 . . . . 3.8700000000000001 112.125 -177.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.685 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -74.01 -13.73 60.91 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.382 0.512 . . . . 2.1400000000000001 112.382 -171.473 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.422 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . 7.7 t70 -91.55 10.95 25.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.006 0.431 . . . . 2.0299999999999998 110.059 178.268 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.492 ' HE3' ' HB2' ' A' ' 67' ' ' LYS . 24.9 ttmt 65.97 39.05 4.66 Favored 'General case' 0 C--N 1.338 0.105 0 CA-C-N 115.627 -0.715 . . . . 3.8599999999999999 109.392 176.473 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.633 ' HB3' ' HB2' ' A' ' 71' ' ' ASP . 64.4 mmtt -78.93 101.29 7.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.2 -0.909 . . . . 2.4900000000000002 112.469 -173.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 28.9 tp -73.81 -59.74 2.58 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.026 -0.534 . . . . 2.8900000000000001 110.146 171.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.421 HD23 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.82 -34.12 76.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.756 -0.657 . . . . 1.6000000000000001 111.821 -170.895 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.633 ' HB2' ' HB3' ' A' ' 68' ' ' LYS . 27.1 m-20 -73.86 -43.55 58.27 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.699 0.259 . . . . 2.0800000000000001 111.699 -176.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 34.9 ptt180 -64.6 -35.37 80.78 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.079 -0.648 . . . . 3.4199999999999999 109.586 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -65.13 -52.99 51.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.874 -0.603 . . . . 1.3700000000000001 110.498 179.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.497 ' CD ' ' HA ' ' A' ' 71' ' ' ASP . 5.8 ptm180 -64.6 -43.46 93.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.254 -0.43 . . . . 2.1000000000000001 111.296 -175.392 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.4 mp -65.56 -48.47 72.3 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.552 0.215 . . . . 2.1299999999999999 110.961 -178.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.746 HG11 HD23 ' A' ' 80' ' ' LEU . 38.2 t -59.86 -43.88 93.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.554 -0.294 . . . . 1.4099999999999999 110.866 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -62.76 -46.83 86.22 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.868 -0.333 . . . . 1.21 111.04 -178.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 63.0 m -61.42 -55.94 25.77 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.17 0.433 . . . . 1.3200000000000001 112.17 -177.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.0 mp -75.29 -50.25 24.94 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 120.968 0.413 . . . . 1.46 111.208 -175.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.945 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.5 mp -71.74 -5.5 34.47 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 116.371 -0.377 . . . . 1.3799999999999999 111.279 -177.072 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -49.92 -63.97 0.95 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.065 0.46 . . . . 2.4199999999999999 109.834 170.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.405 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 5.4 pt-20 -75.39 -31.43 60.45 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.156 -0.474 . . . . 2.9100000000000001 110.929 177.309 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.945 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 34.0 tt0 -58.48 -43.96 89.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.543 -0.299 . . . . 1.6599999999999999 111.127 -177.222 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.746 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 69.3 mt -57.54 -30.6 65.33 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.127 -0.488 . . . . 1.27 111.671 179.435 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.405 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 24.4 mm-40 -59.54 -17.93 36.39 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.848 0.356 . . . . 0.96999999999999997 111.121 -177.202 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.524 ' HB2' HD11 ' A' ' 29' ' ' ILE . 23.4 m-80 -102.44 3.05 37.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.428 -0.351 . . . . 1.02 110.957 -177.007 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.487 HG23 ' HB2' ' A' ' 90' ' ' PHE . 8.9 mt -124.12 147.67 28.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.645 0.259 . . . . 1.3100000000000001 110.564 -175.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.542 ' HB3' ' O ' ' A' ' 53' ' ' THR . 59.0 t60 -78.97 -45.18 20.88 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.811 -0.44 . . . . 2.29 109.811 175.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.495 ' HB2' ' HB3' ' A' ' 54' ' ' SER . . . -158.92 106.16 1.81 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 1.3999999999999999 110.504 178.446 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . 0.487 ' HB2' HG23 ' A' ' 87' ' ' ILE . 76.2 t80 -103.35 138.02 40.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.259 -0.428 . . . . 0.63 110.357 177.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 50.7 m -140.26 145.14 36.94 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.668 -0.493 . . . . 1.9399999999999999 109.668 175.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -123.35 151.79 42.16 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.168 0.508 . . . . 1.27 111.637 -175.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.0 mmtm -117.38 118.28 31.8 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.437 -0.801 . . . . 2.71 108.957 173.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.472 ' HA ' ' CG1' ' A' ' 59' ' ' ILE . 80.8 m -83.78 117.23 23.13 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.137 0.494 . . . . 2.0 111.605 -171.143 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 70.2 m80 -140.33 161.22 38.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.958 -0.565 . . . . 2.6099999999999999 110.332 176.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.639 ' HB ' ' HD2' ' A' ' 97' ' ' PRO . 31.0 p -110.63 168.25 7.88 Favored Pre-proline 0 C--N 1.32 -0.676 0 N-CA-C 109.209 -0.664 . . . . 1.27 109.209 174.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.639 ' HD2' ' HB ' ' A' ' 96' ' ' THR . 12.1 Cg_endo -58.29 -28.53 84.88 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.092 1.861 . . . . 1.0900000000000001 111.456 174.128 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -72.92 -51.44 18.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 2.6200000000000001 109.883 178.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.567 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 1.5 mp0 -58.54 -50.99 71.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.008 -0.542 . . . . 2.6899999999999999 111.133 179.357 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -65.21 -43.39 91.71 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.742 0.275 . . . . 1.6100000000000001 111.742 -175.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.469 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 33.3 t70 -62.99 -33.31 75.14 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.988 0.423 . . . . 1.23 110.769 -177.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.598 ' HE2' ' N ' ' A' ' 102' ' ' LYS . 0.3 OUTLIER -78.41 -15.53 58.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.486 -0.325 . . . . 3.1499999999999999 111.173 179.024 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 93.6 mt -76.49 -51.69 11.26 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.087 0.47 . . . . 1.5900000000000001 109.947 175.365 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.469 ' HG3' ' O ' ' A' ' 101' ' ' ASP . 5.2 ptmt -65.53 -8.62 20.59 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.653 -0.703 . . . . 2.3199999999999998 111.137 177.22 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.7 t -72.35 -17.39 61.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.039 -0.528 . . . . 2.21 110.555 178.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.38 -147.28 0.28 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.779 -0.452 . . . . 4.4400000000000004 109.779 174.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -99.36 52.85 1.05 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.995 -0.621 . . . . 3.9199999999999999 112.338 -175.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 51.1 m . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.212 -0.899 . . . . 4.9800000000000004 110.208 177.316 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.7 ptp . . . . . 0 N--CA 1.48 1.045 0 CA-C-O 120.879 0.371 . . . . 36.359999999999999 110.562 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -101.74 102.81 2.41 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.962 -0.637 . . . . 33.770000000000003 111.574 175.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.8 m -85.61 150.9 24.31 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.708 0.29 . . . . 32.670000000000002 110.401 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.2 m -81.83 37.63 0.48 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.266 -0.424 . . . . 30.75 111.208 -177.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -57.53 107.55 0.45 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.062 -0.517 . . . . 28.739999999999998 110.61 -179.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 74.6 t60 66.38 4.87 3.42 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.547 -0.751 . . . . 29.030000000000001 111.583 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -93.05 23.13 4.46 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.659 0.742 . . . . 26.800000000000001 109.512 -178.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -148.07 175.0 11.37 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.657 -0.701 . . . . 24.5 109.595 -178.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 7.4 t-160 -88.8 136.69 32.87 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.129 -0.323 . . . . 24.210000000000001 110.129 -178.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 44.2 t-80 -93.11 146.64 23.5 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.425 -0.352 . . . . 20.899999999999999 110.679 -175.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.1 m 76.34 -50.11 0.59 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.679 0.792 . . . . 20.109999999999999 112.649 174.027 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.6 m -88.88 17.43 5.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.195 0.521 . . . . 17.379999999999999 110.895 -178.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -83.66 43.27 3.14 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.792 -0.64 . . . . 16.75 111.791 -175.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.541 ' HB2' HD23 ' A' ' 44' ' ' LEU . 14.9 ptp180 -118.84 -32.94 4.36 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.287 0.565 . . . . 19.629999999999999 109.658 -178.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -100.47 -3.46 30.8 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.488 -0.778 . . . . 14.57 111.505 -174.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.454 ' C ' HD21 ' A' ' 16' ' ' ASN . 0.4 OUTLIER -72.35 -0.55 12.66 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.207 0.447 . . . . 16.100000000000001 112.207 -174.163 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.0 mp -82.88 -16.13 48.76 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.132 -0.321 . . . . 16.719999999999999 110.132 176.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -127.88 168.43 15.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.407 -0.36 . . . . 15.609999999999999 111.072 -175.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 35.7 p90 -94.76 10.82 33.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.111 -0.495 . . . . 11.970000000000001 111.784 -177.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 73.47 -53.57 0.69 Allowed 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 113.356 0.873 . . . . 10.890000000000001 113.356 173.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -73.34 63.6 1.76 Allowed Glycine 0 CA--C 1.523 0.536 0 N-CA-C 114.664 0.626 . . . . 7.0 114.664 -170.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -171.72 157.58 4.68 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.799 -0.815 . . . . 6.5999999999999996 108.799 177.066 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 82.8 mtp -73.56 80.41 1.48 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.361 0.601 . . . . 4.7999999999999998 110.31 177.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.8 m -91.13 124.36 35.29 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.281 -0.872 . . . . 2.2000000000000002 110.004 -179.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.482 ' O ' HD12 ' A' ' 29' ' ' ILE . 0.0 OUTLIER -57.18 -35.51 48.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.233 -0.439 . . . . 1.8200000000000001 110.049 179.672 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.818 HE22 ' HG ' ' A' ' 44' ' ' LEU . 53.6 tp60 -57.35 -53.78 54.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.9 -0.591 . . . . 1.99 110.924 177.341 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.9 tptp -63.88 -40.78 97.32 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.894 -0.594 . . . . 2.9300000000000002 111.04 -173.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 66.6 t -60.55 -46.94 94.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.208 -0.451 . . . . 1.6299999999999999 111.041 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.525 ' HA ' ' OE2' ' A' ' 83' ' ' GLU . 1.5 mp -58.84 -47.08 90.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.932 -0.576 . . . . 1.3300000000000001 110.398 179.036 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.526 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 74.8 mt-10 -56.03 -52.0 65.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 2.2000000000000002 111.003 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -63.34 -36.82 84.96 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.833 0.679 . . . . 1.6699999999999999 112.833 -172.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -72.57 -47.87 44.58 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.53 -0.468 . . . . 2.5299999999999998 111.61 -177.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.473 HD13 ' N ' ' A' ' 34' ' ' SER . 4.6 pp -74.26 -31.41 62.55 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 120.581 -0.448 . . . . 1.24 111.722 -179.197 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.473 ' N ' HD13 ' A' ' 33' ' ' LEU . 66.4 m -68.69 -33.58 74.21 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 121.151 -0.22 . . . . 1.6599999999999999 111.4 -178.195 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.5 m -67.85 -27.33 66.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.95 0.405 . . . . 0.79000000000000004 110.812 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.95 -52.74 4.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 1.24 111.767 -177.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 73.2 mt -85.0 -33.06 22.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.532 -0.304 . . . . 1.49 111.738 -173.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm 55.48 75.2 0.62 Allowed Pre-proline 0 N--CA 1.466 0.364 0 CA-C-N 116.045 -0.525 . . . . 3.8500000000000001 112.173 -178.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.49 ' HB3' HG12 ' A' ' 59' ' ' ILE . 72.4 Cg_endo -82.7 133.77 7.13 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.408 2.072 . . . . 0.67000000000000004 111.989 175.498 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 37.7 p -73.09 -30.53 63.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.578 0.704 . . . . 1.3700000000000001 109.753 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -141.88 132.55 25.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.111 -0.95 . . . . 0.83999999999999997 109.328 176.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.1 tt -142.24 118.95 11.08 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.196 -0.668 . . . . 2.1899999999999999 109.196 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -116.96 120.51 38.63 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.89 0.376 . . . . 2.23 110.348 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.818 ' HG ' HE22 ' A' ' 26' ' ' GLN . 4.3 mm? -87.86 121.24 30.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.853 -0.612 . . . . 2.23 110.212 178.154 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 40.9 t -109.35 122.11 63.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.215 -0.448 . . . . 1.72 110.339 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -67.92 102.52 1.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.4 -0.593 . . . . 1.8300000000000001 109.4 176.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.506 ' HD2' ' HB2' ' A' ' 56' ' ' ASP . 51.8 tttm -88.42 44.62 1.21 Allowed 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.362 -0.606 . . . . 3.2400000000000002 109.362 -178.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.6 m 65.56 75.69 0.34 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-N 114.986 -1.007 . . . . 3.3799999999999999 110.107 -176.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.1 p -53.7 -60.08 3.77 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.423 -0.808 . . . . 5.1600000000000001 110.769 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 55.59 -131.12 49.09 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 116.091 -0.504 . . . . 3.3300000000000001 113.085 175.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 34.1 m -85.39 22.34 1.54 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.017 0.437 . . . . 4.6299999999999999 110.875 -178.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 99.14 63.73 0.84 Allowed Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.92 -0.657 . . . . 2.7599999999999998 111.695 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.0 m -92.89 -87.65 0.23 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.573 0.225 . . . . 3.98 111.367 -179.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.9 m -154.58 155.81 35.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.834 0.35 . . . . 2.04 110.987 -175.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -125.28 136.17 53.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.945 -0.57 . . . . 1.3 109.6 173.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.506 ' HB2' ' HD2' ' A' ' 47' ' ' LYS . 19.3 t70 -113.24 122.39 47.31 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.89 -0.411 . . . . 1.3500000000000001 109.89 -177.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -118.77 122.27 42.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.773 0.321 . . . . 1.23 111.606 -175.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 58.3 t -86.86 111.23 21.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 109.552 -0.536 . . . . 1.1799999999999999 109.552 176.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.49 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -110.01 116.31 51.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.485 0.659 . . . . 1.9399999999999999 110.627 -176.521 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.648 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 41.8 t -108.09 114.06 45.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.356 -0.838 . . . . 1.3700000000000001 109.382 176.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.427 ' HB3' ' HA ' ' A' ' 39' ' ' PRO . 87.5 p -145.66 146.38 31.28 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.245 -0.582 . . . . 1.3100000000000001 112.256 -177.188 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -67.22 -22.8 65.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.462 -0.79 . . . . 1.6699999999999999 110.755 172.251 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -62.59 -32.11 73.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.094 -0.503 . . . . 1.8100000000000001 112.282 -172.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 31.6 m-85 -98.41 0.51 45.48 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.959 -0.297 . . . . 3.8700000000000001 111.256 -178.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.08 -18.97 62.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.556 -0.293 . . . . 2.1400000000000001 111.742 -173.644 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -84.46 -9.66 58.18 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.918 0.389 . . . . 2.0299999999999998 110.862 -175.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt 69.12 19.57 7.94 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.884 0.698 . . . . 3.8599999999999999 112.884 169.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.656 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 29.0 mmmt -75.07 110.76 9.65 Favored 'General case' 0 C--N 1.327 -0.41 0 O-C-N 121.771 -0.581 . . . . 2.4900000000000002 109.627 178.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.492 ' HA ' ' NE ' ' A' ' 72' ' ' ARG . 3.4 pp -66.53 -48.11 70.76 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.319 0.489 . . . . 2.8900000000000001 112.319 -167.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.419 HD21 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.82 -30.93 70.46 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.877 0.37 . . . . 1.6000000000000001 110.767 -178.204 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.419 ' N ' HD21 ' A' ' 70' ' ' LEU . 20.4 t70 -73.32 -47.54 41.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.003 -0.544 . . . . 2.0800000000000001 110.341 -175.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.656 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 10.9 ptt85 -66.68 -33.93 76.75 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.409 -0.36 . . . . 3.4199999999999999 110.806 177.044 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -66.82 -50.29 63.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.48 -0.327 . . . . 1.3700000000000001 110.739 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -65.67 -37.33 86.19 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.61 -0.268 . . . . 2.1000000000000001 110.995 -176.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 66.9 mt -64.13 -57.85 8.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.843 0.354 . . . . 2.1299999999999999 110.886 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.738 HG11 HD12 ' A' ' 80' ' ' LEU . 64.4 t -57.41 -49.99 78.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.053 -0.521 . . . . 1.4099999999999999 111.541 -176.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.449 ' N ' HD21 ' A' ' 77' ' ' ASN . 0.9 OUTLIER -65.69 -42.89 90.68 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.959 -0.296 . . . . 1.21 111.57 -174.447 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 85.2 m -63.24 -53.98 44.47 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.852 0.316 . . . . 1.3200000000000001 111.852 -176.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.4 mp -76.95 -51.1 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.81 0.338 . . . . 1.46 111.196 -177.109 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.855 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 15.4 mt -72.06 -15.16 62.02 Favored 'General case' 0 C--O 1.214 -0.8 0 N-CA-C 113.068 0.766 . . . . 1.3799999999999999 113.068 -171.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 31.3 tttm -65.82 -56.11 13.61 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 119.163 0.892 . . . . 2.4199999999999999 109.892 175.556 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -58.37 -32.58 68.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.323 -0.853 . . . . 2.9100000000000001 109.499 176.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.664 ' HG2' HD22 ' A' ' 80' ' ' LEU . 6.0 tp10 -60.48 -53.74 53.88 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 114.912 -1.04 . . . . 1.6599999999999999 111.11 176.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.855 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 45.4 mt -50.33 -30.65 12.56 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 114.276 -1.329 . . . . 1.27 112.059 178.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 -51.79 -24.83 6.52 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 111.721 0.267 . . . . 0.96999999999999997 111.721 -177.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.515 ' HB2' HD11 ' A' ' 29' ' ' ILE . 32.5 m-80 -94.07 -6.77 44.36 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.839 0.352 . . . . 1.02 111.417 -178.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 2.7 mt -120.26 151.18 22.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 109.891 -0.411 . . . . 1.3100000000000001 109.891 -174.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -75.48 -45.81 36.18 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.267 -0.573 . . . . 2.29 109.721 175.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.67 117.26 3.99 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.024 -0.534 . . . . 1.3999999999999999 110.18 177.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -116.02 122.35 44.95 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.108 -0.496 . . . . 0.63 110.669 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.7 p -115.33 129.5 56.62 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.322 -0.399 . . . . 1.9399999999999999 110.253 176.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -107.33 139.49 41.72 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.162 0.506 . . . . 1.27 110.591 -178.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -108.14 111.03 22.84 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.088 -0.708 . . . . 2.71 109.088 176.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 45.8 t -83.23 116.14 22.26 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.339 -0.391 . . . . 2.0 110.354 -174.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.648 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 59.2 t60 -130.12 138.98 50.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.478 0.656 . . . . 2.6099999999999999 110.35 -178.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -98.2 146.36 31.4 Favored Pre-proline 0 C--N 1.318 -0.803 0 CA-C-N 115.561 -0.745 . . . . 1.27 111.383 -179.364 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -67.14 -21.84 48.05 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.962 2.441 . . . . 1.0900000000000001 112.808 -178.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -64.14 -51.29 64.59 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.045 -0.724 . . . . 2.6200000000000001 109.045 177.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -70.76 -29.58 65.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.997 -0.547 . . . . 2.6899999999999999 110.653 178.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -62.27 -41.05 98.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.197 -0.456 . . . . 1.6100000000000001 110.662 178.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -60.97 -33.66 73.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 1.23 110.943 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.704 ' HE2' ' N ' ' A' ' 102' ' ' LYS . 0.5 OUTLIER -71.6 -24.95 61.98 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.32 -0.4 . . . . 3.1499999999999999 110.952 -179.552 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 86.1 mt -75.57 -51.79 12.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.36 -0.382 . . . . 1.5900000000000001 110.25 178.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.4 -15.69 63.65 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.1 -0.5 . . . . 2.3199999999999998 111.592 178.336 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 37.0 t -69.95 -47.63 61.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.414 -0.357 . . . . 2.21 110.478 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 42.6 pttt -101.18 -175.76 2.96 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.246 0.546 . . . . 4.4400000000000004 111.322 -177.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -135.36 29.0 2.96 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 111.223 -0.751 . . . . 3.9199999999999999 111.223 176.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 26.0 p . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.519 -0.753 . . . . 4.9800000000000004 109.841 -178.745 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.6 mtp . . . . . 0 N--CA 1.479 1.02 0 N-CA-C 110.113 -0.328 . . . . 36.359999999999999 110.113 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -82.21 -67.61 1.49 Allowed Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.727 -0.749 . . . . 33.770000000000003 111.573 177.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.1 m -142.65 41.8 1.58 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.084 0.469 . . . . 32.670000000000002 110.301 -179.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.1 m -78.98 72.77 5.51 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.911 -0.586 . . . . 30.75 111.591 -176.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 21.2 t-160 -92.52 58.91 3.25 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 107.995 -1.113 . . . . 28.739999999999998 107.995 171.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.557 ' HE1' ' HB3' ' A' ' 34' ' ' SER . 78.0 t60 -67.25 -21.87 65.7 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.284 -1.325 . . . . 29.030000000000001 111.394 -173.196 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.3 t-160 -80.89 99.51 8.38 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.277 -0.638 . . . . 26.800000000000001 109.277 175.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 18.2 m-70 -92.72 -179.78 5.25 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.02 -0.536 . . . . 24.5 110.577 -177.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.17 79.41 1.81 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.897 -0.592 . . . . 24.210000000000001 110.203 176.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -81.61 67.25 7.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.539 -0.755 . . . . 20.899999999999999 109.03 178.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.5 t -73.25 -21.31 60.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.566 -0.743 . . . . 20.109999999999999 110.851 -173.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.2 p -66.56 100.59 0.68 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.916 -0.584 . . . . 17.379999999999999 110.521 176.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -91.79 -30.43 10.47 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.839 -0.619 . . . . 16.75 112.561 -176.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.29 -22.75 4.65 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.971 0.415 . . . . 19.629999999999999 110.957 -179.364 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -97.76 13.85 28.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.233 -0.44 . . . . 14.57 111.459 -176.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -81.65 1.34 34.48 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.906 0.384 . . . . 16.100000000000001 110.866 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -94.66 5.83 50.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.992 -0.549 . . . . 16.719999999999999 110.299 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -120.38 -175.79 3.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.171 0.51 . . . . 15.609999999999999 111.583 -177.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.7 p90 -89.66 18.09 5.83 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.197 -0.91 . . . . 11.970000000000001 110.617 -179.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -59.85 100.55 0.09 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.519 -0.764 . . . . 10.890000000000001 111.072 178.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.88 89.37 2.1 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.643 -0.789 . . . . 7.0 112.583 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -73.49 112.66 9.77 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.43 -0.582 . . . . 6.5999999999999996 109.43 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 63.7 mtt -119.05 163.34 17.14 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.818 0.342 . . . . 4.7999999999999998 111.341 -176.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 43.4 t -70.96 148.35 47.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.587 -0.733 . . . . 2.2000000000000002 110.725 177.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.4 tp -52.5 -39.45 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 115.669 -0.696 . . . . 1.8200000000000001 111.75 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -64.83 -39.32 93.38 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.199 0.523 . . . . 1.99 110.914 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -70.34 -40.02 74.36 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.513 -0.767 . . . . 2.9300000000000002 110.658 -177.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.3 t -66.21 -46.38 87.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.899 -0.591 . . . . 1.6299999999999999 111.082 -178.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.575 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.5 mp -59.49 -49.3 84.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 1.3300000000000001 111.44 -178.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -61.17 -39.14 89.01 Favored 'General case' 0 C--O 1.226 -0.177 0 N-CA-C 110.244 -0.28 . . . . 2.2000000000000002 110.244 -177.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -64.2 -44.24 92.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.528 -0.305 . . . . 1.6699999999999999 111.079 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -70.53 -55.48 8.79 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 112.343 0.498 . . . . 2.5299999999999998 112.343 -173.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 3.3 pp -68.69 -29.3 67.72 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.433 -0.507 . . . . 1.24 111.498 -175.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.557 ' HB3' ' HE1' ' A' ' 6' ' ' HIS . 55.0 m -73.4 -35.67 65.91 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.794 -0.362 . . . . 1.6599999999999999 111.349 177.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.9 m -67.0 -27.46 67.44 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.851 -0.34 . . . . 0.79000000000000004 111.092 176.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -92.38 -54.9 3.61 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 112.431 0.53 . . . . 1.24 112.431 -176.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.7 mt -79.46 -26.6 41.68 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.832 0.349 . . . . 1.49 110.673 -177.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 65.1 mttm 59.3 72.92 0.74 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.278 -0.874 . . . . 3.8500000000000001 112.671 176.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.516 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 84.6 Cg_endo -91.29 165.71 3.62 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 122.876 2.384 . . . . 0.67000000000000004 111.635 172.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 28.6 p -94.22 -32.27 13.75 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.038 0.446 . . . . 1.3700000000000001 110.258 178.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.692 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 82.8 t80 -133.05 134.37 44.28 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.776 -0.647 . . . . 0.83999999999999997 109.867 178.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -142.29 113.31 7.53 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.563 -0.532 . . . . 2.1899999999999999 109.563 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -111.56 134.69 52.96 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.953 -0.388 . . . . 2.23 109.953 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -110.92 124.9 53.02 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.782 0.325 . . . . 2.23 110.944 -178.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 48.3 t -127.84 133.9 66.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.056 -0.52 . . . . 1.72 109.692 175.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.405 ' HA ' ' O ' ' A' ' 54' ' ' SER . 5.6 t70 -75.03 134.0 41.51 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 120.91 0.386 . . . . 1.8300000000000001 110.164 175.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -93.36 -10.46 35.23 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.084 -0.507 . . . . 3.2400000000000002 110.323 -178.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.532 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 20.1 m 62.24 28.72 17.16 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.748 -0.66 . . . . 3.3799999999999999 111.516 178.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 47.4 t -78.55 105.23 9.68 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.714 -0.476 . . . . 5.1600000000000001 109.714 178.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.32 -115.25 5.24 Favored Glycine 0 N--CA 1.445 -0.72 0 N-CA-C 111.422 -0.671 . . . . 3.3300000000000001 111.422 -177.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 72.0 m -103.62 16.92 25.26 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.137 0.494 . . . . 4.6299999999999999 110.697 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.532 ' HA2' ' HA ' ' A' ' 48' ' ' SER . . . 85.35 38.21 9.2 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.657 -0.783 . . . . 2.7599999999999998 112.697 177.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.9 p -119.59 52.87 1.07 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.674 0.75 . . . . 3.98 109.841 175.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.405 ' O ' ' HA ' ' A' ' 46' ' ' ASP . 21.7 p -135.55 132.18 36.89 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.041 -0.982 . . . . 2.04 110.471 -175.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -118.8 132.43 56.13 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 121.014 -0.274 . . . . 1.3 110.86 -178.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -113.0 113.02 24.89 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 107.754 -1.202 . . . . 1.3500000000000001 107.754 171.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.0 117.88 35.17 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.172 0.511 . . . . 1.23 112.251 -169.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 61.1 t -83.64 112.28 20.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.675 -0.693 . . . . 1.1799999999999999 109.641 175.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.642 HG13 ' HA ' ' A' ' 94' ' ' CYS . 1.0 OUTLIER -100.53 140.02 20.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.254 -0.43 . . . . 1.9399999999999999 110.502 -176.051 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.692 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 95.1 t -127.98 107.44 16.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 108.864 -0.791 . . . . 1.3700000000000001 108.864 171.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.516 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 43.5 t -155.78 154.87 32.07 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.073 0.463 . . . . 1.3100000000000001 112.028 -174.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.469 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 0.8 OUTLIER -67.07 -19.47 65.67 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 115.558 -0.747 . . . . 1.6699999999999999 110.333 173.98 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -58.02 -30.47 66.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.608 -0.724 . . . . 1.8100000000000001 111.031 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -94.73 -11.1 29.73 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.185 0.517 . . . . 3.8700000000000001 110.665 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.469 ' HB3' ' HA ' ' A' ' 62' ' ' ASN . 0.6 OUTLIER -91.42 -16.13 27.83 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 108.643 -0.873 . . . . 2.1400000000000001 108.643 -176.962 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -74.22 0.64 13.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.374 -0.83 . . . . 2.0299999999999998 109.843 175.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 53.3 mmtt 64.98 37.81 6.67 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 114.837 -1.074 . . . . 3.8599999999999999 110.864 175.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.858 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 42.3 mmtm -96.1 92.07 6.25 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.063 -0.517 . . . . 2.4900000000000002 111.148 177.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.8 tt -73.64 -57.29 4.09 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.436 -0.579 . . . . 2.8900000000000001 109.436 177.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.427 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -68.18 -32.26 72.37 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.043 -0.526 . . . . 1.6000000000000001 111.448 -177.388 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.858 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 24.3 t70 -74.09 -38.65 63.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.363 -0.38 . . . . 2.0800000000000001 111.431 -173.164 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 50.9 ptt85 -62.63 -34.54 77.26 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.422 -0.511 . . . . 3.4199999999999999 109.851 177.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 73.4 t60 -69.05 -46.6 67.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.271 -0.422 . . . . 1.3700000000000001 110.53 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.523 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 3.7 ptm180 -68.17 -38.77 82.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.659 -0.246 . . . . 2.1000000000000001 110.884 -178.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -65.67 -47.58 75.03 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.833 -0.167 . . . . 2.1299999999999999 111.028 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.511 HG12 HD22 ' A' ' 80' ' ' LEU . 37.2 t -57.51 -45.4 85.94 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 CA-C-N 116.567 -0.288 . . . . 1.4099999999999999 110.665 177.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.534 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -67.35 -29.5 69.07 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.93 -0.308 . . . . 1.21 111.622 -179.031 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 91.5 m -66.25 -48.3 70.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.794 0.33 . . . . 1.3200000000000001 111.019 -178.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 21.0 mt -81.8 -51.14 15.54 Favored 'Isoleucine or valine' 0 C--O 1.242 0.671 0 CA-C-O 121.952 0.882 . . . . 1.46 110.62 -177.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.928 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.3 mp -74.67 -0.13 16.97 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.195 -0.912 . . . . 1.3799999999999999 111.27 -176.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.534 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 56.0 tptt -50.86 -63.71 1.04 Allowed 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 108.949 -0.76 . . . . 2.4199999999999999 108.949 169.523 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -75.49 -35.68 60.76 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.906 -0.588 . . . . 2.9100000000000001 110.968 176.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.928 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 30.7 tt0 -59.5 -41.18 89.29 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 111.868 0.321 . . . . 1.6599999999999999 111.868 -175.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 41.0 mt -56.46 -30.68 63.2 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.185 0.439 . . . . 1.27 112.185 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -57.83 -18.23 20.97 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.72 0.295 . . . . 0.96999999999999997 111.566 -174.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -100.27 -4.34 29.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.717 -0.22 . . . . 1.02 111.515 -177.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 6.1 mt -115.38 152.12 17.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 109.923 -0.399 . . . . 1.3100000000000001 109.923 -177.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -84.43 -38.24 20.44 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.825 -0.435 . . . . 2.29 109.825 176.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -161.08 108.41 1.49 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.213 -0.449 . . . . 1.3999999999999999 111.029 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -105.64 138.29 42.08 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.012 0.434 . . . . 0.63 110.869 176.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 44.5 m -134.61 158.84 43.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.872 -0.604 . . . . 1.9399999999999999 109.485 175.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -137.0 147.56 46.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.22 0.533 . . . . 1.27 111.755 -176.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 48.7 mmtm -119.3 109.33 15.68 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.44 -0.8 . . . . 2.71 108.978 173.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.642 ' HA ' HG13 ' A' ' 59' ' ' ILE . 4.5 p -84.01 121.29 27.2 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.059 0.457 . . . . 2.0 111.315 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -131.79 153.88 49.67 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.333 0.587 . . . . 2.6099999999999999 111.224 176.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 17.8 p -97.37 148.55 34.58 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.572 -0.74 . . . . 1.27 110.55 177.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -62.16 -30.25 81.86 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.621 2.214 . . . . 1.0900000000000001 111.979 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.52 -51.34 60.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.667 -0.697 . . . . 2.6200000000000001 109.965 -179.138 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.423 ' HA ' ' HE3' ' A' ' 102' ' ' LYS . 12.6 tp10 -72.57 -30.98 64.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.856 0.36 . . . . 2.6899999999999999 110.489 -178.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -56.09 -35.21 66.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.864 -0.607 . . . . 1.6100000000000001 111.595 -179.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.449 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 23.8 t70 -62.7 -36.57 83.37 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 121.094 -0.242 . . . . 1.23 111.031 -176.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.423 ' HE3' ' HA ' ' A' ' 99' ' ' GLU . 0.0 OUTLIER -66.62 -33.14 74.99 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.117 0.484 . . . . 3.1499999999999999 110.495 178.16 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 69.1 mt -67.97 -46.59 70.94 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.903 -0.589 . . . . 1.5900000000000001 110.251 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' ' 101' ' ' ASP . 0.0 OUTLIER -75.02 -8.25 55.98 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.109 -0.496 . . . . 2.3199999999999998 111.977 -179.45 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 50.2 m -59.97 -42.68 94.67 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.947 0.404 . . . . 2.21 109.986 174.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.425 ' HE3' ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -100.44 -41.18 7.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.123 -0.49 . . . . 4.4400000000000004 110.26 175.191 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.85 44.57 7.66 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 121.017 -0.611 . . . . 3.9199999999999999 112.661 176.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.0 p . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.943 -0.551 . . . . 4.9800000000000004 110.877 179.271 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.6 tpt . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 120.862 0.363 . . . . 36.359999999999999 110.391 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 91.66 -138.01 14.06 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.386 -0.911 . . . . 33.770000000000003 112.368 177.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.512 ' HA ' ' OD2' ' A' ' 46' ' ' ASP . 74.9 m -60.3 118.2 6.13 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.699 0.761 . . . . 32.670000000000002 112.797 -174.012 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.5 m -125.39 -21.12 4.62 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.502 -1.226 . . . . 30.75 109.563 176.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -100.75 112.17 24.53 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.052 -0.522 . . . . 28.739999999999998 109.949 178.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -105.94 118.32 36.3 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.43 -0.35 . . . . 29.030000000000001 110.135 178.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 49.3 t60 -70.79 129.55 39.39 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.864 -0.421 . . . . 26.800000000000001 109.864 177.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 11.8 t-80 -67.93 114.96 6.92 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.507 -0.553 . . . . 24.5 109.507 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.0 t-80 -78.69 53.23 1.31 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.506 0.67 . . . . 24.210000000000001 111.296 -174.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -170.48 133.42 1.04 Allowed 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.636 -0.875 . . . . 20.899999999999999 108.636 176.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 63.0 m -56.55 109.85 0.69 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.172 0.51 . . . . 20.109999999999999 111.2 -179.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.2 p -134.15 48.73 2.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.514 -0.766 . . . . 17.379999999999999 110.013 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.463 ' HA2' ' ND2' ' A' ' 16' ' ' ASN . . . -84.8 23.78 7.34 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.508 -0.769 . . . . 16.75 112.478 -176.183 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 46.2 mtm180 -102.43 -50.69 3.53 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.738 0.78 . . . . 19.629999999999999 109.635 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -97.82 -16.56 19.77 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.762 -1.108 . . . . 14.57 112.01 -174.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.463 ' ND2' ' HA2' ' A' ' 13' ' ' GLY . 0.1 OUTLIER -74.0 8.74 1.87 Allowed 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.129 0.418 . . . . 16.100000000000001 112.129 -175.356 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.421 HD13 ' ND2' ' A' ' 16' ' ' ASN . 8.6 mp -82.04 -10.98 59.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.15 0.5 . . . . 16.719999999999999 110.131 176.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.413 ' C ' ' H ' ' A' ' 20' ' ' GLN . 97.5 m-85 -107.18 127.83 53.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.933 -0.576 . . . . 15.609999999999999 110.214 -179.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -77.14 33.19 0.15 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.029 -0.532 . . . . 11.970000000000001 111.825 -179.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.413 ' H ' ' C ' ' A' ' 18' ' ' TYR . 30.6 mm-40 -67.94 109.09 3.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.323 -0.399 . . . . 10.890000000000001 110.691 179.588 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -142.88 -159.72 8.06 Favored Glycine 0 N--CA 1.445 -0.722 0 C-N-CA 120.735 -0.745 . . . . 7.0 111.817 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 50.0 t60 -106.51 155.48 19.55 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.826 -0.435 . . . . 6.5999999999999996 109.826 -178.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.6 mmt -58.02 100.52 0.06 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.121 0.486 . . . . 4.7999999999999998 110.857 175.076 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 79.5 m -146.5 160.1 42.55 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.626 -0.715 . . . . 2.2000000000000002 109.606 179.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.8 tp -54.8 -31.93 25.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 O-C-N 123.386 0.429 . . . . 1.8200000000000001 111.414 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -58.6 -49.15 78.52 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.586 -0.279 . . . . 1.99 110.98 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.586 ' HE3' ' OE2' ' A' ' 30' ' ' GLU . 10.2 mmmm -70.91 -27.35 63.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.475 -0.33 . . . . 2.9300000000000002 111.372 -177.025 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 81.8 t -58.82 -54.12 38.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.902 0.382 . . . . 1.6299999999999999 110.067 176.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.486 HG12 HD12 ' A' ' 87' ' ' ILE . 1.8 mp -64.95 -48.78 82.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.615 -0.721 . . . . 1.3300000000000001 110.509 178.336 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.586 ' OE2' ' HE3' ' A' ' 27' ' ' LYS . 27.1 tt0 -58.16 -52.21 66.5 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.966 -0.561 . . . . 2.2000000000000002 111.461 -175.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.447 ' HB2' ' O ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -68.13 -31.98 71.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.542 -0.299 . . . . 1.6699999999999999 111.299 -176.059 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -66.19 -55.66 15.18 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 120.588 0.233 . . . . 2.5299999999999998 110.995 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 4.0 pp -72.8 -23.84 60.84 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.793 -0.363 . . . . 1.24 111.467 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.561 ' O ' ' HA ' ' A' ' 38' ' ' LYS . 22.7 t -69.08 -36.35 77.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.1 0.476 . . . . 1.6599999999999999 110.131 176.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.3 m -71.68 -48.92 44.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.221 -0.445 . . . . 0.79000000000000004 110.812 177.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.61 -54.76 6.84 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.614 0.598 . . . . 1.24 112.614 -173.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.8 mt -80.69 -33.41 35.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.937 0.398 . . . . 1.49 110.272 -177.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.561 ' HA ' ' O ' ' A' ' 34' ' ' SER . 18.7 ttmm 58.01 81.22 0.26 Allowed Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.045 -0.98 . . . . 3.8500000000000001 112.154 174.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.759 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 5.4 Cg_endo -87.08 147.85 7.94 Favored 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 123.165 2.577 . . . . 0.67000000000000004 112.197 178.321 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.22 -22.58 33.09 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.456 0.646 . . . . 1.3700000000000001 109.794 176.122 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.664 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 64.4 t80 -141.63 127.6 19.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.235 -0.893 . . . . 0.83999999999999997 109.156 171.164 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 48.6 tp -142.32 133.8 26.56 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.396 -0.366 . . . . 2.1899999999999999 110.273 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -149.6 139.8 22.19 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.858 0.361 . . . . 2.23 110.536 174.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.417 ' N ' HD21 ' A' ' 44' ' ' LEU . 3.1 mm? -88.61 124.68 34.29 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.499 -0.556 . . . . 2.23 109.499 176.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 59.1 t -103.17 135.35 41.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.703 -0.48 . . . . 1.72 109.703 -178.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.512 ' OD2' ' HA ' ' A' ' 3' ' ' SER . 10.3 t70 -69.41 105.01 2.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.905 -1.043 . . . . 1.8300000000000001 111.082 -172.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.587 ' HE2' ' HB2' ' A' ' 56' ' ' ASP . 16.0 tppt? -95.28 70.75 3.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.402 0.62 . . . . 3.2400000000000002 109.705 179.344 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 29.8 t -69.64 -16.46 63.37 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.544 -0.753 . . . . 3.3799999999999999 110.248 178.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 50.3 t -103.44 92.94 4.69 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.068 -0.514 . . . . 5.1600000000000001 109.63 175.102 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -169.1 -141.59 3.26 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.746 -0.74 . . . . 3.3300000000000001 111.852 -178.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 56.6 m -109.59 81.11 1.39 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.733 0.302 . . . . 4.6299999999999999 110.451 -179.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.5 -88.12 0.52 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.176 -0.535 . . . . 2.7599999999999998 112.289 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.5 m -115.65 101.79 9.16 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.256 0.551 . . . . 3.98 109.749 177.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.5 m -128.66 149.35 50.7 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.613 -0.721 . . . . 2.04 109.968 -177.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -136.39 143.36 43.95 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.592 -0.276 . . . . 1.3 110.481 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.587 ' HB2' ' HE2' ' A' ' 47' ' ' LYS . 38.7 t70 -122.0 115.27 22.22 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.016 -0.735 . . . . 1.3500000000000001 109.016 175.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.03 119.42 39.14 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.026 0.441 . . . . 1.23 111.648 -171.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.491 ' HA ' ' HB2' ' A' ' 93' ' ' LYS . 62.2 t -75.71 111.25 11.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.229 -0.656 . . . . 1.1799999999999999 109.229 175.223 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.493 HD13 ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER -113.67 110.53 32.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.911 0.862 . . . . 1.9399999999999999 110.487 -176.782 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.664 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 98.2 t -107.81 106.44 20.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 114.747 -1.115 . . . . 1.3700000000000001 108.945 175.596 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.759 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 40.4 t -151.55 155.13 37.84 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.344 0.592 . . . . 1.3100000000000001 111.792 -173.118 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.508 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 0.8 OUTLIER -62.02 -19.23 62.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.971 -1.013 . . . . 1.6699999999999999 111.66 176.269 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.445 ' OD1' ' HB3' ' A' ' 61' ' ' SER . 28.4 p-10 -63.78 -26.18 68.52 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.705 0.288 . . . . 1.8100000000000001 111.285 -179.182 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.548 ' HD2' HG22 ' A' ' 96' ' ' THR . 59.6 t80 -90.63 -13.2 34.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.439 0.638 . . . . 3.8700000000000001 109.674 176.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.508 ' HB3' ' HA ' ' A' ' 62' ' ' ASN . 0.9 OUTLIER -87.36 -11.03 50.54 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 108.878 -0.786 . . . . 2.1400000000000001 108.878 -179.668 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -63.31 -19.46 64.62 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.029 -0.987 . . . . 2.0299999999999998 110.451 178.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm 78.61 -28.28 0.16 Allowed 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.07 0.948 . . . . 3.8599999999999999 111.883 176.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -71.24 100.03 2.02 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.929 0.395 . . . . 2.4900000000000002 110.377 178.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.503 HD13 ' N ' ' A' ' 70' ' ' LEU . 4.0 pp -70.04 -36.31 74.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.277 -0.42 . . . . 2.8900000000000001 111.432 -175.312 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.503 ' N ' HD13 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -67.79 -32.96 73.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.801 0.334 . . . . 1.6000000000000001 110.942 178.951 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.536 ' HA ' ' HG2' ' A' ' 74' ' ' ARG . 7.2 m-20 -74.08 -37.73 64.13 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 120.888 0.375 . . . . 2.0800000000000001 110.126 177.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -57.64 -43.3 84.77 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.377 -0.601 . . . . 3.4199999999999999 109.377 172.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 30.7 t60 -63.42 -53.31 54.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.558 -0.746 . . . . 1.3700000000000001 111.143 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.536 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 9.9 ptm180 -63.69 -36.6 84.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.3 -0.409 . . . . 2.1000000000000001 111.6 -175.658 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -63.96 -49.48 72.34 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.77 0.319 . . . . 2.1299999999999999 110.773 178.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.402 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 74.6 t -58.57 -42.82 85.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.069 -0.514 . . . . 1.4099999999999999 110.297 176.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.524 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -64.3 -35.41 80.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.297 -0.41 . . . . 1.21 111.45 179.372 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 86.8 m -62.2 -51.33 68.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.838 0.351 . . . . 1.3200000000000001 111.446 -178.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.404 HD12 ' N ' ' A' ' 79' ' ' ILE . 2.9 mp -80.03 -48.88 19.87 Favored 'Isoleucine or valine' 0 C--O 1.241 0.617 0 CA-C-O 121.44 0.638 . . . . 1.46 110.927 -177.295 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.861 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.5 mp -74.94 -2.27 26.28 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.933 -0.576 . . . . 1.3799999999999999 111.441 -175.206 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.524 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 56.9 tptt -51.6 -64.1 0.92 Allowed 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 109.497 -0.557 . . . . 2.4199999999999999 109.497 171.208 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.422 ' HG3' ' N ' ' A' ' 83' ' ' GLU . 2.4 pt-20 -75.07 -33.68 61.71 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.001 -0.545 . . . . 2.9100000000000001 110.867 176.319 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.861 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 5.2 tp10 -55.18 -53.6 53.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.193 0.521 . . . . 1.6599999999999999 112.049 -175.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 70.3 mt -50.39 -30.67 12.91 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.269 -0.878 . . . . 1.27 112.472 178.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -57.21 -24.34 53.9 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.023 0.44 . . . . 0.96999999999999997 110.733 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -91.67 -10.82 38.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.064 -0.517 . . . . 1.02 111.47 -175.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.486 HD12 HG12 ' A' ' 29' ' ' ILE . 3.1 mt -120.46 164.13 17.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.746 -0.464 . . . . 1.3100000000000001 109.746 -176.667 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -92.24 -46.36 7.76 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.505 -0.554 . . . . 2.29 109.505 175.163 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -148.3 109.6 4.36 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.032 -0.531 . . . . 1.3999999999999999 110.514 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -116.77 127.41 54.32 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.295 -0.412 . . . . 0.63 110.547 177.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 37.0 p -124.44 167.07 14.92 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.412 -0.588 . . . . 1.9399999999999999 109.412 175.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -143.51 146.01 33.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.919 0.39 . . . . 1.27 111.132 -178.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.491 ' HB2' ' HA ' ' A' ' 58' ' ' VAL . 44.5 mmtm -97.42 109.35 22.12 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.003 -0.74 . . . . 2.71 109.003 174.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 3.9 p -89.9 111.56 22.65 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.062 -0.517 . . . . 2.0 111.018 -174.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.459 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 1.7 m80 -138.3 156.82 47.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.985 -0.552 . . . . 2.6099999999999999 110.671 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.548 HG22 ' HD2' ' A' ' 64' ' ' PHE . 47.5 p -98.16 153.47 38.09 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.225 -0.443 . . . . 1.27 110.272 177.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -64.39 -22.21 66.09 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.35 2.033 . . . . 1.0900000000000001 111.191 175.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -68.56 -44.0 75.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.262 -0.881 . . . . 2.6200000000000001 109.411 177.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 57.0 tt0 -75.9 -35.63 59.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.473 -0.785 . . . . 2.6899999999999999 110.132 178.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -58.43 -32.49 68.74 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.931 -0.577 . . . . 1.6100000000000001 110.957 178.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -52.03 -36.28 49.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.11 -0.495 . . . . 1.23 111.589 177.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -77.57 -35.43 53.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.101 0.477 . . . . 3.1499999999999999 110.167 178.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 66.3 mt -77.3 -24.27 50.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.748 -0.66 . . . . 1.5900000000000001 111.709 -173.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.42 ' HG3' ' N ' ' A' ' 105' ' ' SER . 41.8 pttt -81.58 -32.68 32.0 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.862 -0.335 . . . . 2.3199999999999998 110.485 177.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.42 ' N ' ' HG3' ' A' ' 104' ' ' LYS . 36.6 m -64.31 -41.97 96.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.996 -0.547 . . . . 2.21 110.009 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.471 ' C ' ' HD2' ' A' ' 106' ' ' LYS . 0.1 OUTLIER -159.43 174.16 15.12 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.698 -0.683 . . . . 4.4400000000000004 110.34 174.912 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -113.8 -19.85 6.32 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.756 -0.735 . . . . 3.9199999999999999 112.702 -173.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 56.4 m . . . . . 0 C--O 1.245 0.854 0 CA-C-O 118.343 -0.837 . . . . 4.9800000000000004 110.236 -177.078 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 46.1 tpp . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 110.124 -0.324 . . . . 36.359999999999999 110.124 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.456 ' HA3' ' HG2' ' A' ' 27' ' ' LYS . . . 179.54 -32.01 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.422 -0.894 . . . . 33.770000000000003 113.047 179.268 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.57 ' HB2' ' HB3' ' A' ' 30' ' ' GLU . 32.5 t -74.38 130.15 39.12 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.993 0.425 . . . . 32.670000000000002 111.06 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.0 t -73.53 128.9 36.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.134 -0.484 . . . . 30.75 109.726 177.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -94.79 21.84 7.05 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.114 -0.493 . . . . 28.739999999999998 111.325 -173.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 72.1 m80 -81.88 112.73 19.27 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.973 -0.558 . . . . 29.030000000000001 109.55 174.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -74.02 82.72 1.74 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.846 -0.615 . . . . 26.800000000000001 110.986 -175.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . 0.53 ' HB3' ' HB2' ' A' ' 11' ' ' SER . 91.4 m-70 -97.39 114.65 26.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.974 -0.557 . . . . 24.5 110.117 177.361 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -82.53 85.42 6.96 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.693 0.283 . . . . 24.210000000000001 110.254 178.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 70.0 t60 69.63 6.96 5.98 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.685 -0.688 . . . . 20.899999999999999 111.278 176.281 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.53 ' HB2' ' HB3' ' A' ' 8' ' ' HIS . 13.2 m -69.09 -38.45 78.98 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.035 0.445 . . . . 20.109999999999999 110.293 177.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 29.6 m -78.58 94.41 5.0 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.909 -0.587 . . . . 17.379999999999999 110.548 -179.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -168.89 40.55 0.22 Allowed Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.754 -0.736 . . . . 16.75 112.283 178.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.3 ptp180 -143.06 -34.35 0.43 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.759 0.314 . . . . 19.629999999999999 111.495 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -85.2 10.74 11.49 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.071 0.463 . . . . 14.57 111.536 -175.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -68.16 -9.3 45.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.624 -0.717 . . . . 16.100000000000001 111.054 176.231 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -62.96 -28.54 70.15 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.117 0.484 . . . . 16.719999999999999 110.045 173.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -98.49 86.66 3.65 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.502 0.668 . . . . 15.609999999999999 109.484 174.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.8 p90 -96.54 11.43 35.16 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.975 -1.012 . . . . 11.970000000000001 111.16 -174.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -78.03 64.95 3.33 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.06 0.457 . . . . 10.890000000000001 110.489 177.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -140.19 68.54 0.48 Allowed Glycine 0 N--CA 1.446 -0.634 0 CA-C-N 115.578 -0.737 . . . . 7.0 111.521 178.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -53.23 135.67 37.84 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.88 0.371 . . . . 6.5999999999999996 111.064 179.647 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.533 ' SD ' ' HD2' ' A' ' 27' ' ' LYS . 24.7 ptt? -143.46 140.57 30.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.313 -0.403 . . . . 4.7999999999999998 111.112 -176.46 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.433 ' O ' HG21 ' A' ' 28' ' ' VAL . 62.3 m -69.0 167.97 14.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.727 -0.67 . . . . 2.2000000000000002 111.391 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.1 tp -61.64 -38.39 80.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 116.165 -0.47 . . . . 1.8200000000000001 111.757 -176.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.2 tt0 -59.3 -43.11 92.65 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.086 0.469 . . . . 1.99 110.504 177.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.533 ' HD2' ' SD ' ' A' ' 23' ' ' MET . 11.7 tmtt? -64.75 -34.55 78.6 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.532 -0.758 . . . . 2.9300000000000002 109.808 -179.176 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.433 HG21 ' O ' ' A' ' 24' ' ' CYS . 93.6 t -61.71 -43.95 97.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.993 -0.549 . . . . 1.6299999999999999 110.49 176.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.477 HD12 ' HB2' ' A' ' 86' ' ' ASN . 1.7 mp -67.22 -42.93 88.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.17 -0.468 . . . . 1.3300000000000001 110.535 178.213 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.57 ' HB3' ' HB2' ' A' ' 3' ' ' SER . 45.1 mt-10 -52.21 -50.38 62.05 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.44 -0.345 . . . . 2.2000000000000002 111.036 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.423 ' HA ' ' HB3' ' A' ' 34' ' ' SER . 4.6 m-20 -78.79 -18.98 53.24 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.249 0.463 . . . . 1.6699999999999999 112.249 -178.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.432 ' HE3' HG22 ' A' ' 79' ' ' ILE . 51.5 tptt -61.46 -55.74 27.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.804 0.335 . . . . 2.5299999999999998 110.21 178.443 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.522 HD12 ' HG ' ' A' ' 42' ' ' LEU . 4.4 pp -73.68 -26.38 60.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.229 -0.442 . . . . 1.24 110.429 176.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.587 ' O ' ' HD2' ' A' ' 38' ' ' LYS . 4.7 t -63.7 -45.96 87.63 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 116.169 -0.468 . . . . 1.6599999999999999 109.907 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.8 m -53.27 -27.89 24.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.955 0.407 . . . . 0.79000000000000004 111.231 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.604 ' HB3' HG12 ' A' ' 79' ' ' ILE . . . -89.22 -43.35 11.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.937 -0.574 . . . . 1.24 112.316 -177.743 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.0 mp -107.06 -36.13 6.68 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.461 0.541 . . . . 1.49 112.461 -173.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.587 ' HD2' ' O ' ' A' ' 34' ' ' SER . 27.9 mmmt 51.01 75.3 0.67 Allowed Pre-proline 0 N--CA 1.468 0.443 0 C-N-CA 123.3 0.64 . . . . 3.8500000000000001 110.845 -168.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -81.97 141.66 12.01 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.716 2.277 . . . . 0.67000000000000004 112.391 -178.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.4 p -60.95 -35.05 75.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.594 -0.73 . . . . 1.3700000000000001 111.182 179.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.675 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 72.4 t80 -138.36 124.09 19.82 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.477 -0.564 . . . . 0.83999999999999997 109.477 175.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.522 ' HG ' HD12 ' A' ' 33' ' ' LEU . 3.3 tm? -142.54 122.62 13.71 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.748 -0.834 . . . . 2.1899999999999999 108.748 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.52 ' O ' ' HA ' ' A' ' 57' ' ' ALA . 10.7 tp10 -143.24 140.48 30.7 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.673 -0.411 . . . . 2.23 111.039 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.441 HD13 ' HG2' ' A' ' 30' ' ' GLU . 10.6 mp -106.74 117.41 33.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.086 0.47 . . . . 2.23 110.771 178.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 52.9 t -106.22 119.26 55.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.73 -0.668 . . . . 1.72 109.956 176.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -73.52 122.84 22.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.998 -0.546 . . . . 1.8300000000000001 110.101 177.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.7 mtmm -110.94 142.36 43.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.283 -0.417 . . . . 3.2400000000000002 110.719 -177.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.6 p -80.2 90.42 5.5 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.417 -0.586 . . . . 3.3799999999999999 109.417 171.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 30.1 t -107.32 13.1 27.44 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.033 -0.531 . . . . 5.1600000000000001 110.81 -174.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 84.38 -40.02 2.93 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.889 -0.672 . . . . 3.3300000000000001 112.76 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 56.0 m -78.46 38.85 0.32 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.797 0.332 . . . . 4.6299999999999999 111.136 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.1 -140.08 29.29 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 121.13 -0.557 . . . . 2.7599999999999998 111.878 -177.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.2 t -77.87 127.35 32.25 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.539 0.685 . . . . 3.98 110.732 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.7 p -138.03 135.53 36.0 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.712 -0.676 . . . . 2.04 109.29 177.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -111.33 132.7 54.2 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.184 0.516 . . . . 1.3 110.747 -175.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -112.59 118.55 35.4 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.191 -0.913 . . . . 1.3500000000000001 108.589 176.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.52 ' HA ' ' O ' ' A' ' 43' ' ' GLU . . . -105.68 115.6 30.52 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.999 0.428 . . . . 1.23 111.68 -173.404 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.406 ' O ' ' HA ' ' A' ' 42' ' ' LEU . 47.3 t -74.43 110.93 9.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 108.589 -0.893 . . . . 1.1799999999999999 108.589 172.389 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.461 HD12 ' HG ' ' A' ' 61' ' ' SER . 0.0 OUTLIER -107.65 109.68 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 CA-C-O 121.862 0.839 . . . . 1.9399999999999999 109.963 -177.687 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.675 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 60.2 t -111.26 105.21 18.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 115.026 -0.988 . . . . 1.3700000000000001 110.088 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.461 ' HG ' HD12 ' A' ' 59' ' ' ILE . 88.2 p -156.75 142.18 17.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.231 0.539 . . . . 1.3100000000000001 111.238 179.647 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.634 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 61.4 m-20 -67.69 -18.49 64.94 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.372 -0.831 . . . . 1.6699999999999999 112.07 177.529 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -48.99 -36.83 18.53 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.878 0.371 . . . . 1.8100000000000001 111.029 177.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.594 ' CE1' ' HA ' ' A' ' 72' ' ' ARG . 21.3 m-30 -101.59 21.4 14.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.955 0.407 . . . . 3.8700000000000001 111.286 -178.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.634 ' HB3' ' O ' ' A' ' 62' ' ' ASN . 0.7 OUTLIER -92.95 -14.57 27.34 Favored 'General case' 0 N--CA 1.426 -1.658 0 N-CA-C 108.407 -0.96 . . . . 2.1400000000000001 108.407 178.847 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -73.21 -4.02 30.39 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.365 -0.834 . . . . 2.0299999999999998 109.916 178.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 99.2 mttt 67.45 25.32 8.57 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.359 -0.837 . . . . 3.8599999999999999 111.888 172.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.469 ' HE2' HD11 ' A' ' 70' ' ' LEU . 13.5 mmmm -93.08 96.53 10.11 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.852 -0.613 . . . . 2.4900000000000002 109.896 178.172 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.463 HD12 ' N ' ' A' ' 70' ' ' LEU . 4.3 pp -72.35 -33.16 67.08 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.968 -0.293 . . . . 2.8900000000000001 110.977 -175.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.512 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.88 -35.16 78.02 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 120.957 -0.297 . . . . 1.6000000000000001 110.682 177.662 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.512 ' N ' HD22 ' A' ' 70' ' ' LEU . 23.0 m-20 -71.66 -45.32 62.32 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 109.567 -0.531 . . . . 2.0800000000000001 109.567 175.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.594 ' HA ' ' CE1' ' A' ' 64' ' ' PHE . 0.5 OUTLIER -52.88 -48.07 67.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.476 -0.784 . . . . 3.4199999999999999 110.033 175.497 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.6 t60 -65.94 -53.03 44.49 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.721 -0.672 . . . . 1.3700000000000001 111.315 -177.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -67.04 -41.65 86.17 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 111.961 0.356 . . . . 2.1000000000000001 111.961 -172.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.99 -49.98 70.33 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.929 0.395 . . . . 2.1299999999999999 110.315 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.757 HG12 HD22 ' A' ' 80' ' ' LEU . 35.0 t -57.74 -46.55 86.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.701 -0.681 . . . . 1.4099999999999999 110.635 178.188 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -61.84 -40.24 94.62 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.611 -0.268 . . . . 1.21 111.583 -178.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 74.8 m -60.99 -51.22 70.17 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 111.626 0.232 . . . . 1.3200000000000001 111.626 -177.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.604 HG12 ' HB3' ' A' ' 36' ' ' ALA . 2.7 mp -81.12 -48.84 18.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 CA-C-O 120.9 0.381 . . . . 1.46 111.295 -176.088 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.834 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.0 mp -69.8 -7.44 39.83 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 116.208 -0.451 . . . . 1.3799999999999999 111.669 -176.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -55.51 -59.71 4.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.273 0.559 . . . . 2.4199999999999999 109.951 171.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -68.64 -37.38 79.65 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.608 -0.724 . . . . 2.9100000000000001 110.178 177.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.834 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 32.9 tt0 -55.27 -41.22 71.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.743 -0.662 . . . . 1.6599999999999999 111.285 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.713 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 57.3 mt -54.84 -30.99 58.88 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 123.082 0.553 . . . . 1.27 112.402 179.426 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -60.2 -18.49 48.65 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.734 0.302 . . . . 0.96999999999999997 111.3 -174.149 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.477 ' HB2' HD12 ' A' ' 29' ' ' ILE . 25.8 m-80 -101.8 4.86 40.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.815 0.34 . . . . 1.02 110.929 -178.476 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 3.3 mt -127.32 163.81 29.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 110.102 -0.332 . . . . 1.3100000000000001 110.102 -175.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -96.55 -52.23 4.02 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.619 -0.511 . . . . 2.29 109.619 173.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -144.4 101.15 3.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.922 -0.581 . . . . 1.3999999999999999 110.311 177.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -93.31 141.47 28.4 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.279 -0.419 . . . . 0.63 110.944 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.5 m -138.38 163.58 31.5 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.742 -0.836 . . . . 1.9399999999999999 108.742 175.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -146.06 151.56 37.92 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.57 -0.452 . . . . 1.27 111.61 -178.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -113.81 116.32 29.16 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.56 -0.746 . . . . 2.71 109.481 176.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 42.5 t -84.23 124.19 30.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.71 0.29 . . . . 2.0 110.724 -177.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.658 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 2.1 t60 -147.99 152.72 37.95 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.868 -0.419 . . . . 2.6099999999999999 109.868 179.122 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.443 ' CG2' ' HB2' ' A' ' 65' ' ' GLU . 0.8 OUTLIER -102.19 151.89 38.16 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-O 120.76 0.314 . . . . 1.27 111.838 178.113 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -59.36 -48.04 14.96 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.999 2.466 . . . . 1.0900000000000001 112.247 -177.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.29 -36.12 81.13 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.83 -0.623 . . . . 2.6200000000000001 111.199 -177.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.555 ' HA ' ' CE ' ' A' ' 102' ' ' LYS . 20.1 tp10 -75.72 -38.51 58.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.773 0.32 . . . . 2.6899999999999999 110.627 -178.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -65.38 -33.25 75.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.871 0.367 . . . . 1.6100000000000001 110.093 176.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -54.48 -43.75 72.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.578 -0.737 . . . . 1.23 111.591 178.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.555 ' CE ' ' HA ' ' A' ' 99' ' ' GLU . 0.0 OUTLIER -61.99 -47.78 83.29 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 120.899 -0.32 . . . . 3.1499999999999999 110.708 177.72 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 62.4 mt -60.43 -46.42 90.1 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.181 -0.463 . . . . 1.5900000000000001 111.309 -176.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -8.44 59.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.351 -0.386 . . . . 2.3199999999999998 111.79 -177.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 35.8 t -67.04 -38.5 85.97 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.195 0.522 . . . . 2.21 110.267 179.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.406 ' HE3' ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -110.73 -41.55 4.26 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.856 -0.611 . . . . 4.4400000000000004 110.581 178.399 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 98.88 51.06 1.42 Allowed Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.889 -0.672 . . . . 3.9199999999999999 111.995 179.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 46.9 m . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.175 -0.917 . . . . 4.9800000000000004 110.121 179.282 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 mmt . . . . . 0 N--CA 1.481 1.101 0 N-CA-C 110.09 -0.337 . . . . 36.359999999999999 110.09 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -97.28 -101.13 2.06 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.765 -0.731 . . . . 33.770000000000003 112.351 -179.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 47.3 m 63.96 22.23 12.9 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.279 0.562 . . . . 32.670000000000002 110.689 -178.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.1 m -88.51 114.6 25.3 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.707 -0.679 . . . . 30.75 111.575 -174.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 70.0 m-70 -102.15 39.69 1.45 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.108 0.48 . . . . 28.739999999999998 109.718 173.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -56.79 133.47 54.28 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.153 -0.931 . . . . 29.030000000000001 110.382 178.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -87.37 125.18 34.1 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.107 -0.497 . . . . 26.800000000000001 110.555 -178.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -107.42 107.65 18.63 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.851 -0.426 . . . . 24.5 109.851 176.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 41.1 p-80 -66.02 133.99 51.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.89 0.376 . . . . 24.210000000000001 110.741 178.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.6 p80 -134.41 144.62 48.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.959 -0.564 . . . . 20.899999999999999 110.132 -178.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.9 t -79.55 110.38 14.82 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.295 0.569 . . . . 20.109999999999999 110.954 -177.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.8 m -128.14 30.44 5.22 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.721 -0.672 . . . . 17.379999999999999 109.3 176.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -75.03 15.72 3.86 Favored Glycine 0 C--N 1.333 0.408 0 CA-C-N 115.593 -0.731 . . . . 16.75 114.043 -172.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 -90.76 -49.21 6.58 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.579 0.704 . . . . 19.629999999999999 109.94 175.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -91.15 30.2 1.28 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.015 -0.993 . . . . 14.57 111.399 -173.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -70.96 -15.46 62.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.272 0.558 . . . . 16.100000000000001 110.208 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 53.4 mt -82.31 -10.63 59.02 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.496 -0.775 . . . . 16.719999999999999 111.108 -177.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -98.38 156.18 16.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.918 0.389 . . . . 15.609999999999999 111.318 -175.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.2 p90 -116.12 -14.19 11.16 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.942 -0.572 . . . . 11.970000000000001 110.421 178.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 72.65 -61.66 0.49 Allowed 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.634 0.774 . . . . 10.890000000000001 112.191 177.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -150.61 -40.57 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.521 -0.847 . . . . 7.0 112.034 -178.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 -152.11 136.67 16.9 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.95 -0.759 . . . . 6.5999999999999996 108.95 -179.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 66.6 mtt -64.8 107.72 1.54 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.514 -0.55 . . . . 4.7999999999999998 109.514 178.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 34.7 m -60.78 159.74 10.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.827 -0.624 . . . . 2.2000000000000002 110.814 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.3 tp -55.01 -34.15 30.89 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 CA-C-N 116.201 -0.454 . . . . 1.8200000000000001 111.157 -178.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 21.2 tm0? -58.83 -47.4 84.94 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.593 -0.276 . . . . 1.99 110.317 177.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.551 ' HA ' ' HB3' ' A' ' 30' ' ' GLU . 53.1 mttt -71.74 -17.82 62.17 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 116.426 -0.352 . . . . 2.9300000000000002 111.671 -178.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 95.3 t -67.25 -51.1 56.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 109.174 -0.676 . . . . 1.6299999999999999 109.174 174.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.584 ' HA ' ' OE2' ' A' ' 83' ' ' GLU . 2.0 mp -61.29 -51.33 74.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 115.135 -0.939 . . . . 1.3300000000000001 109.646 174.559 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.551 ' HB3' ' HA ' ' A' ' 27' ' ' LYS . 34.1 tt0 -53.06 -51.77 60.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.303 -0.862 . . . . 2.2000000000000002 111.564 -178.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -61.87 -45.52 93.41 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.974 -0.557 . . . . 1.6699999999999999 111.799 -174.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -68.42 -47.52 67.03 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.378 -0.529 . . . . 2.5299999999999998 112.24 -175.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.477 HD13 ' N ' ' A' ' 34' ' ' SER . 4.2 pp -70.8 -27.69 64.08 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.095 -0.642 . . . . 1.24 110.987 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.477 ' N ' HD13 ' A' ' 33' ' ' LEU . 46.5 t -66.66 -46.34 76.03 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.937 -0.394 . . . . 1.6599999999999999 109.937 175.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.8 m -71.35 -27.73 63.56 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.297 -0.41 . . . . 0.79000000000000004 111.337 -179.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.61 -43.17 20.96 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.082 0.401 . . . . 1.24 112.082 -176.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 85.8 mt -104.46 -38.05 6.95 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.724 0.268 . . . . 1.49 111.724 -174.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.3 mttm 53.6 90.37 0.09 OUTLIER Pre-proline 0 N--CA 1.467 0.384 0 CA-C-O 121.647 0.737 . . . . 3.8500000000000001 112.642 -175.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.804 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 5.2 Cg_endo -87.74 158.73 7.62 Favored 'Trans proline' 0 N--CA 1.451 -1.022 0 C-N-CA 123.155 2.57 . . . . 0.67000000000000004 112.047 175.024 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 21.6 p -82.77 -26.19 32.08 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.742 0.782 . . . . 1.3700000000000001 109.031 173.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.561 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 91.6 t80 -140.1 132.33 28.17 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.695 -1.139 . . . . 0.83999999999999997 109.268 173.542 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.563 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 59.3 tp -136.18 122.64 20.74 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.941 -0.392 . . . . 2.1899999999999999 109.941 -179.063 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.497 ' HB3' ' HB ' ' A' ' 58' ' ' VAL . 34.9 tt0 -119.88 119.86 34.75 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.432 -0.349 . . . . 2.23 110.061 -179.284 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -104.09 115.85 31.16 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.023 -0.362 . . . . 2.23 110.023 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 50.1 t -121.91 124.71 71.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.632 -0.258 . . . . 1.72 110.762 -178.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -82.07 122.63 28.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.113 0.482 . . . . 1.8300000000000001 109.984 174.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -96.47 107.77 20.22 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.874 -0.603 . . . . 3.2400000000000002 110.538 -178.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 36.4 m -79.92 27.93 0.29 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.822 -0.626 . . . . 3.3799999999999999 111.408 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 17.0 t -78.57 99.15 6.4 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.039 -0.726 . . . . 5.1600000000000001 109.039 178.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 109.83 -118.1 5.0 Favored Glycine 0 N--CA 1.445 -0.72 0 N-CA-C 110.913 -0.875 . . . . 3.3300000000000001 110.913 -173.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 36.9 t -157.01 147.39 21.23 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.711 0.291 . . . . 4.6299999999999999 110.478 177.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 104.52 -140.79 15.11 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 111.386 -0.685 . . . . 2.7599999999999998 111.386 -178.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.7 t -136.82 134.47 37.0 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.386 0.612 . . . . 3.98 110.493 176.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.524 ' HB3' ' O ' ' A' ' 89' ' ' ALA . 68.6 m -146.29 135.95 23.19 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.501 -0.772 . . . . 2.04 108.969 179.675 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.448 ' HB2' ' CD1' ' A' ' 90' ' ' PHE . 81.2 m-85 -111.57 132.66 54.39 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.599 0.714 . . . . 1.3 111.385 -170.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -110.81 113.85 26.75 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 107.702 -1.221 . . . . 1.3500000000000001 107.702 173.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.34 116.12 31.39 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.298 0.571 . . . . 1.23 111.382 -173.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.497 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 44.8 t -83.61 111.12 19.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 108.791 -0.818 . . . . 1.1799999999999999 108.791 174.462 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.423 HG21 ' HA ' ' A' ' 94' ' ' CYS . 0.0 OUTLIER -110.14 107.84 23.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 121.876 0.846 . . . . 1.9399999999999999 110.553 -176.207 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.561 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 94.4 t -107.72 108.01 24.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 114.86 -1.063 . . . . 1.3700000000000001 109.013 176.253 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.804 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 45.2 t -151.36 154.78 37.35 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.254 0.549 . . . . 1.3100000000000001 112.112 -173.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.488 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 14.9 m120 -66.53 -19.44 65.78 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.233 -0.894 . . . . 1.6699999999999999 110.27 174.126 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -64.69 -20.79 66.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.916 -0.584 . . . . 1.8100000000000001 110.537 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -110.47 7.01 22.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.36 0.6 . . . . 3.8700000000000001 110.042 178.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.488 ' HB3' ' O ' ' A' ' 62' ' ' ASN . 0.5 OUTLIER -76.69 -28.34 55.88 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 109.347 -0.612 . . . . 2.1400000000000001 109.347 -177.008 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -71.72 -8.57 54.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.815 -0.63 . . . . 2.0299999999999998 110.225 172.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 54.6 mttp 65.73 29.44 10.7 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.384 -0.826 . . . . 3.8599999999999999 112.165 171.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.432 ' HB3' ' OD2' ' A' ' 71' ' ' ASP . 14.2 mmmm -90.71 96.11 10.48 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.024 0.44 . . . . 2.4900000000000002 109.974 175.571 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.437 HD13 ' N ' ' A' ' 70' ' ' LEU . 3.8 pp -73.48 -36.77 65.86 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.98 -0.555 . . . . 2.8900000000000001 111.521 -174.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.447 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.87 -32.26 72.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.717 0.294 . . . . 1.6000000000000001 110.972 178.496 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.447 ' N ' HD22 ' A' ' 70' ' ' LEU . 4.1 m-20 -66.84 -49.39 65.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.914 0.388 . . . . 2.0800000000000001 110.666 -179.533 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.426 ' HG3' ' O ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -66.08 -26.83 67.66 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.827 -0.349 . . . . 3.4199999999999999 110.344 178.724 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -69.51 -50.03 49.01 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 116.278 -0.419 . . . . 1.3700000000000001 111.001 -179.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.415 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 11.6 ptm180 -66.7 -36.31 82.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.66 -0.245 . . . . 2.1000000000000001 111.169 -178.418 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.84 -50.59 55.83 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 120.711 0.291 . . . . 2.1299999999999999 111.034 177.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.541 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 8.9 p -61.77 -35.4 67.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.298 0 CA-C-N 116.496 -0.32 . . . . 1.4099999999999999 110.25 -179.087 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.585 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -69.62 -33.66 72.96 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.625 -0.261 . . . . 1.21 110.996 177.741 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 66.8 m -59.48 -51.72 68.66 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.707 0.289 . . . . 1.3200000000000001 111.344 179.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.0 mp -83.18 -47.55 18.2 Favored 'Isoleucine or valine' 0 C--O 1.244 0.796 0 CA-C-O 121.681 0.753 . . . . 1.46 111.149 -177.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.778 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.3 mp -77.31 -0.45 25.54 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.176 -0.466 . . . . 1.3799999999999999 112.121 -173.679 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.585 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 56.9 tptt -58.68 -57.77 11.54 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.26 -0.644 . . . . 2.4199999999999999 109.26 171.824 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -72.15 -34.12 68.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.3 -0.863 . . . . 2.9100000000000001 109.99 177.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.778 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.7 tp10 -54.86 -51.03 67.21 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.628 -0.714 . . . . 1.6599999999999999 112.468 178.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 52.7 mt -50.35 -30.42 12.15 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.283 -0.871 . . . . 1.27 113.252 -176.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -53.73 -19.63 4.43 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.269 0.47 . . . . 0.96999999999999997 112.269 -174.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -101.86 -4.0 27.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.77 0.319 . . . . 1.02 111.54 -177.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.46 HD12 HG12 ' A' ' 29' ' ' ILE . 12.6 mt -114.94 151.7 16.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.482 -0.326 . . . . 1.3100000000000001 110.136 -174.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -84.99 -55.23 4.16 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.804 -0.358 . . . . 2.29 110.099 177.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.524 ' O ' ' HB3' ' A' ' 54' ' ' SER . . . -144.16 91.22 2.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.937 0.399 . . . . 1.3999999999999999 111.185 178.292 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . 0.448 ' CD1' ' HB2' ' A' ' 55' ' ' PHE . 63.7 t80 -86.4 141.41 29.18 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.323 -0.399 . . . . 0.63 110.002 177.067 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 8.8 m -141.04 158.56 43.77 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.372 -0.603 . . . . 1.9399999999999999 109.372 177.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -138.65 147.14 42.51 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.932 0.396 . . . . 1.27 111.124 -179.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -115.97 109.54 17.71 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.664 -0.698 . . . . 2.71 109.725 175.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.423 ' HA ' HG21 ' A' ' 59' ' ' ILE . 7.9 p -85.6 123.82 31.45 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.719 0.295 . . . . 2.0 110.623 -177.707 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.494 ' HD2' ' HG2' ' A' ' 99' ' ' GLU . 3.7 m80 -144.0 160.52 40.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.165 0.507 . . . . 2.6099999999999999 110.99 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.441 ' CG2' ' HA ' ' A' ' 65' ' ' GLU . 11.5 p -102.75 153.69 38.03 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 115.489 -0.778 . . . . 1.27 111.132 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -58.12 -28.76 84.9 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.721 2.281 . . . . 1.0900000000000001 111.69 175.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.53 -47.16 76.75 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.896 -0.593 . . . . 2.6200000000000001 110.285 177.599 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.494 ' HG2' ' HD2' ' A' ' 95' ' ' HIS . 6.4 tp10 -67.05 -51.82 49.82 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.629 -0.714 . . . . 2.6899999999999999 110.657 179.38 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -62.11 -32.39 72.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.917 -0.583 . . . . 1.6100000000000001 110.966 -176.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.475 ' HA ' ' HE2' ' A' ' 104' ' ' LYS . 25.7 t70 -55.42 -33.24 63.37 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.035 -0.53 . . . . 1.23 111.072 178.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.429 ' N ' ' HE3' ' A' ' 102' ' ' LYS . 0.6 OUTLIER -76.55 -43.51 38.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.971 0.415 . . . . 3.1499999999999999 110.223 176.8 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 86.2 mt -65.25 -49.57 69.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.799 -0.637 . . . . 1.5900000000000001 111.492 -175.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.475 ' HE2' ' HA ' ' A' ' 101' ' ' ASP . 47.8 pttt -57.52 -25.3 59.66 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.193 -0.458 . . . . 2.3199999999999998 111.694 -176.346 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.486 ' HB3' ' HD2' ' A' ' 106' ' ' LYS . 44.4 t -62.68 -20.66 65.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.847 -0.615 . . . . 2.21 111.391 -175.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.486 ' HD2' ' HB3' ' A' ' 105' ' ' SER . 0.0 OUTLIER -144.74 -42.44 0.24 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.831 0.308 . . . . 4.4400000000000004 111.831 -179.16 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 101.58 19.14 16.56 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.961 -0.638 . . . . 3.9199999999999999 111.869 -178.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 10.0 t . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.453 -0.784 . . . . 4.9800000000000004 109.738 -178.037 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.9 ptm . . . . . 0 N--CA 1.48 1.05 0 CA-C-O 120.654 0.264 . . . . 36.359999999999999 110.445 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 77.93 -89.62 1.07 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 121.009 -0.615 . . . . 33.770000000000003 112.784 175.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -71.0 123.9 23.12 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.544 0.211 . . . . 32.670000000000002 110.616 -178.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.6 t -155.07 137.92 15.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.195 0.521 . . . . 30.75 111.167 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 7.7 t-160 -158.03 109.58 2.26 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 107.633 -1.247 . . . . 28.739999999999998 107.633 174.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.542 ' HA ' ' O ' ' A' ' 104' ' ' LYS . 93.9 m-70 -62.02 109.28 1.23 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.471 0.653 . . . . 29.030000000000001 112.156 -168.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.552 ' HB2' ' HB2' ' A' ' 104' ' ' LYS . 24.0 m170 -134.42 168.49 18.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.565 -1.198 . . . . 26.800000000000001 109.678 179.626 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 15.8 p80 -116.11 177.8 4.55 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.523 -0.917 . . . . 24.5 108.523 171.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 57.8 m170 -59.86 120.9 10.47 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.269 -1.012 . . . . 24.210000000000001 108.269 174.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -63.5 -16.36 60.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.864 -0.607 . . . . 20.899999999999999 111.852 -166.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.9 m 64.64 30.23 12.69 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.462 0.649 . . . . 20.109999999999999 110.506 177.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.615 ' HA ' ' NH1' ' A' ' 14' ' ' ARG . 32.3 m -100.16 165.3 11.57 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.247 -0.888 . . . . 17.379999999999999 109.819 177.136 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 163.28 -15.13 0.11 Allowed Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.486 -0.864 . . . . 16.75 113.279 -178.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.615 ' NH1' ' HA ' ' A' ' 12' ' ' SER . 0.5 OUTLIER -107.88 -19.31 13.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 117.676 0.738 . . . . 19.629999999999999 111.314 -177.183 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.464 ' OE2' ' HD2' ' A' ' 14' ' ' ARG . 1.2 pm0 -87.66 13.76 9.79 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.608 -0.269 . . . . 14.57 111.602 -176.052 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -76.92 -11.04 59.76 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.368 -0.604 . . . . 16.100000000000001 109.368 174.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.7 mp -91.8 -0.95 57.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.43 -0.804 . . . . 16.719999999999999 110.031 175.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.413 ' HB3' HE22 ' A' ' 20' ' ' GLN . 84.4 m-85 -120.47 93.03 3.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.237 0.542 . . . . 15.609999999999999 111.521 -175.355 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.412 ' HZ ' ' HG3' ' A' ' 27' ' ' LYS . 28.0 t80 -111.34 81.32 1.42 Allowed 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.423 -0.808 . . . . 11.970000000000001 109.935 176.097 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.413 HE22 ' HB3' ' A' ' 18' ' ' TYR . 0.8 OUTLIER -141.06 132.57 26.96 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.008 -0.542 . . . . 10.890000000000001 110.671 179.019 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -176.0 -78.54 0.05 OUTLIER Glycine 0 N--CA 1.446 -0.652 0 CA-C-N 115.67 -0.695 . . . . 7.0 111.375 178.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -148.92 138.29 21.71 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.78 -0.452 . . . . 6.5999999999999996 109.78 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 84.1 mtp -94.96 127.7 41.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.199 0.524 . . . . 4.7999999999999998 110.845 -179.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.501 ' O ' HG22 ' A' ' 28' ' ' VAL . 42.4 t -155.84 150.72 26.32 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.646 -0.872 . . . . 2.2000000000000002 108.646 176.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.538 ' O ' HG12 ' A' ' 29' ' ' ILE . 8.7 tp -53.07 -38.2 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 O-C-N 123.501 0.501 . . . . 1.8200000000000001 111.626 -175.531 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -62.01 -52.26 64.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.807 0.337 . . . . 1.99 110.614 179.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.412 ' HG3' ' HZ ' ' A' ' 19' ' ' PHE . 17.4 tppt? -64.97 -31.45 72.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.101 -0.5 . . . . 2.9300000000000002 110.774 -178.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.501 HG22 ' O ' ' A' ' 24' ' ' CYS . 89.5 t -61.79 -46.45 96.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 110.125 -0.324 . . . . 1.6299999999999999 110.125 175.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.578 HG22 HD11 ' A' ' 87' ' ' ILE . 51.3 mm -63.14 -43.07 98.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.132 -0.486 . . . . 1.3300000000000001 110.342 177.283 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -54.18 -51.94 62.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.982 -0.553 . . . . 2.2000000000000002 111.005 177.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.441 ' HA ' ' HG ' ' A' ' 34' ' ' SER . 16.5 t70 -67.65 -34.55 77.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.183 0.516 . . . . 1.6699999999999999 111.007 -179.55 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.518 ' HG2' ' OE1' ' A' ' 83' ' ' GLU . 13.5 tptp -60.18 -55.89 28.31 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.517 -0.765 . . . . 2.5299999999999998 111.388 -177.423 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -74.16 -29.76 61.93 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.984 -0.286 . . . . 1.24 111.722 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.441 ' HG ' ' HA ' ' A' ' 31' ' ' ASP . 73.6 p -72.04 -33.4 67.97 Favored 'General case' 0 C--O 1.224 -0.248 0 C-N-CA 121.089 -0.244 . . . . 1.6599999999999999 111.241 -177.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.2 m -65.79 -27.32 68.19 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.826 0.346 . . . . 0.79000000000000004 111.042 176.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.29 -49.47 6.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.385 -0.37 . . . . 1.24 111.672 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.6 mt -83.11 -30.15 28.16 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.855 0.317 . . . . 1.49 111.855 -177.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 16.3 mmtm 55.68 81.82 0.25 Allowed Pre-proline 0 N--CA 1.466 0.329 0 C-N-CA 123.175 0.59 . . . . 3.8500000000000001 112.331 -176.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.661 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 69.0 Cg_endo -92.62 139.23 1.81 Allowed 'Trans proline' 0 N--CA 1.448 -1.195 0 C-N-CA 122.887 2.392 . . . . 0.67000000000000004 111.947 174.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 13.7 p -68.41 -32.5 72.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.22 0.533 . . . . 1.3700000000000001 110.298 176.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.481 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 69.1 t80 -141.97 131.76 24.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.491 -0.777 . . . . 0.83999999999999997 109.472 176.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.7 tp -141.87 112.87 7.41 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.756 0.312 . . . . 2.1899999999999999 110.535 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -125.74 139.17 53.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.493 -0.321 . . . . 2.23 110.322 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.447 ' HG ' ' HB3' ' A' ' 57' ' ' ALA . 7.2 mp -117.12 122.41 44.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.541 -0.3 . . . . 2.23 110.497 -178.434 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.423 HG21 ' HB3' ' A' ' 56' ' ' ASP . 9.6 m -112.75 150.79 14.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.017 0.437 . . . . 1.72 111.135 178.115 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -78.28 119.58 21.84 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.793 -0.64 . . . . 1.8300000000000001 110.235 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 21.5 ttmm -100.16 124.91 46.13 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.223 -0.444 . . . . 3.2400000000000002 109.862 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.2 p -79.43 106.42 11.44 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.194 -0.457 . . . . 3.3799999999999999 111.284 -177.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 49.7 t -113.86 15.51 18.58 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.337 0.589 . . . . 5.1600000000000001 109.692 176.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 81.11 -111.63 3.33 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.831 -0.699 . . . . 3.3300000000000001 111.585 -177.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 40.4 t -88.26 101.34 13.76 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.169 -0.678 . . . . 4.6299999999999999 109.169 174.169 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 127.92 99.79 1.02 Allowed Glycine 0 N--CA 1.446 -0.683 0 N-CA-C 110.811 -0.915 . . . . 2.7599999999999998 110.811 -174.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.1 p -78.17 99.93 6.41 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.01 0.433 . . . . 3.98 111.322 -176.21 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.0 p -87.81 144.2 26.73 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.997 -0.547 . . . . 2.04 110.711 178.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -111.63 132.74 54.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.415 -0.357 . . . . 1.3 110.621 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.423 ' HB3' HG21 ' A' ' 45' ' ' VAL . 5.2 t70 -107.76 110.37 22.17 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.33 -0.619 . . . . 1.3500000000000001 109.33 179.08 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.447 ' HB3' ' HG ' ' A' ' 44' ' ' LEU . . . -106.17 115.8 30.84 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.99 0.424 . . . . 1.23 111.315 -177.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 56.2 t -82.02 111.18 18.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.81 -0.632 . . . . 1.1799999999999999 109.32 175.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -104.41 108.8 25.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.667 0.746 . . . . 1.9399999999999999 110.13 -176.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.605 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 60.4 t -106.5 106.67 21.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.175 -0.92 . . . . 1.3700000000000001 109.27 177.13 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.661 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 30.0 t -142.31 147.93 37.17 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.012 0.434 . . . . 1.3100000000000001 112.081 -174.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.614 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 25.0 m120 -67.13 -20.68 65.8 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.5 -0.773 . . . . 1.6699999999999999 110.891 174.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -61.51 -23.96 66.28 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.939 -0.573 . . . . 1.8100000000000001 111.154 -177.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -100.65 -5.3 26.82 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.476 -0.329 . . . . 3.8700000000000001 111.477 -175.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.614 ' HG2' ' O ' ' A' ' 62' ' ' ASN . 7.7 pt-20 -77.58 -2.17 34.42 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 120.401 -0.52 . . . . 2.1400000000000001 111.457 -174.11 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -92.86 4.49 53.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.227 0.536 . . . . 2.0299999999999998 109.939 176.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt 71.82 15.21 5.85 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.18 -0.918 . . . . 3.8599999999999999 111.062 175.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm -76.39 89.7 3.21 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.195 0.522 . . . . 2.4900000000000002 110.963 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -73.92 -50.01 22.09 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.609 -0.723 . . . . 2.8900000000000001 109.899 179.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.514 HD23 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.61 -34.58 77.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.117 -0.492 . . . . 1.6000000000000001 111.215 -175.754 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.514 ' N ' HD23 ' A' ' 70' ' ' LEU . 9.4 t70 -73.76 -37.03 65.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.316 0.579 . . . . 2.0800000000000001 109.878 -178.559 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.42 ' O ' HG22 ' A' ' 76' ' ' VAL . 1.3 tmt_? -63.42 -41.88 98.71 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.752 -0.658 . . . . 3.4199999999999999 110.018 172.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -63.02 -47.01 84.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.089 -0.505 . . . . 1.3700000000000001 111.155 -178.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.469 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 3.5 ptm180 -66.18 -35.66 81.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.466 -0.334 . . . . 2.1000000000000001 110.963 -177.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.84 -48.34 71.96 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 110.244 -0.28 . . . . 2.1299999999999999 110.244 176.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.531 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 64.6 t -56.92 -42.49 78.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.083 -0.508 . . . . 1.4099999999999999 110.678 177.292 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.91 -42.95 94.31 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.989 -0.284 . . . . 1.21 111.548 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 57.4 m -65.92 -49.09 69.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.03 0.443 . . . . 1.3200000000000001 111.349 -176.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.412 ' HB ' HD11 ' A' ' 80' ' ' LEU . 35.1 mt -72.4 -53.37 19.66 Favored 'Isoleucine or valine' 0 C--O 1.241 0.643 0 CA-C-O 121.742 0.782 . . . . 1.46 110.708 -178.329 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 1.024 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.4 mp -79.57 -0.31 33.05 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.175 -0.92 . . . . 1.3799999999999999 111.965 -172.435 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -53.81 -63.92 0.99 Allowed 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.475 -0.49 . . . . 2.4199999999999999 109.688 173.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -75.76 -33.08 60.21 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.096 -0.502 . . . . 2.9100000000000001 110.884 173.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 1.024 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 1.8 tp10 -52.83 -52.88 55.35 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.787 0.327 . . . . 1.6599999999999999 111.683 -177.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.652 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 61.9 mt -50.49 -30.83 13.71 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.48 -0.782 . . . . 1.27 112.465 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -57.81 -22.38 47.15 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 120.745 0.307 . . . . 0.96999999999999997 111.077 -177.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -90.47 -7.01 54.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.811 0.338 . . . . 1.02 111.174 -178.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.578 HD11 HG22 ' A' ' 29' ' ' ILE . 6.9 mt -123.72 135.45 63.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.504 -0.316 . . . . 1.3100000000000001 110.498 -174.283 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -69.33 -46.74 66.34 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.561 -0.533 . . . . 2.29 109.561 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -151.94 101.36 2.73 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.239 -0.437 . . . . 1.3999999999999999 110.947 178.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . 0.508 ' HB2' HG21 ' A' ' 87' ' ' ILE . 79.1 t80 -103.01 139.28 38.77 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.944 0.402 . . . . 0.63 111.028 178.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.7 m -135.19 149.49 49.94 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.32 -0.622 . . . . 1.9399999999999999 109.32 174.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -134.42 134.23 41.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.106 0.479 . . . . 1.27 111.105 -178.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -106.48 116.74 32.46 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.805 -0.634 . . . . 2.71 109.377 177.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 7.2 p -83.62 129.39 34.96 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.016 0.436 . . . . 2.0 111.613 -175.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.605 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 0.1 OUTLIER -145.09 158.23 43.88 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.802 -0.636 . . . . 2.6099999999999999 109.67 176.063 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -112.03 153.99 44.39 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 116.413 -0.358 . . . . 1.27 111.627 -178.507 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -61.89 -26.86 79.48 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 123.11 2.54 . . . . 1.0900000000000001 112.724 -176.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 98' ' ' LEU . 1.2 tm? -62.45 -51.41 67.62 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.777 -0.453 . . . . 2.6200000000000001 109.777 -178.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.55 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 6.4 mp0 -66.82 -38.8 87.17 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.38 -0.373 . . . . 2.6899999999999999 111.0 177.168 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -59.42 -39.72 84.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.586 -0.279 . . . . 1.6100000000000001 111.05 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.503 ' HA ' ' HE3' ' A' ' 104' ' ' LYS . 24.9 t70 -58.46 -34.43 70.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 1.23 110.524 179.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.704 ' HE2' ' N ' ' A' ' 102' ' ' LYS . 0.6 OUTLIER -76.44 -35.47 58.48 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.399 -0.364 . . . . 3.1499999999999999 110.537 178.455 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 69.8 mt -65.69 -46.68 78.11 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.94 -0.573 . . . . 1.5900000000000001 111.396 -178.109 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.552 ' HB2' ' HB2' ' A' ' 7' ' ' HIS . 0.1 OUTLIER -77.8 -21.9 50.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 2.3199999999999998 111.973 -176.339 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.419 ' N ' ' HD2' ' A' ' 104' ' ' LYS . 41.9 m -82.78 -60.66 2.1 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.995 0.426 . . . . 2.21 110.919 179.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.454 ' HE3' ' OXT' ' A' ' 108' ' ' SER . 44.6 pttt -114.09 -56.83 2.35 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.11 -0.495 . . . . 4.4400000000000004 110.824 -175.032 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 123.89 -30.9 4.71 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 121.075 -0.583 . . . . 3.9199999999999999 112.027 -179.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' SER . . . . . 0.454 ' OXT' ' HE3' ' A' ' 106' ' ' LYS . 52.7 p . . . . . 0 C--O 1.251 1.179 0 CA-C-O 118.573 -0.727 . . . . 4.9800000000000004 110.761 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.3 mtt . . . . . 0 N--CA 1.48 1.065 0 CA-C-O 120.936 0.398 . . . . 36.359999999999999 110.194 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 139.54 -159.6 25.85 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 111.327 -0.709 . . . . 33.770000000000003 111.327 -177.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.3 t -88.3 89.8 8.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.09 0.472 . . . . 32.670000000000002 110.328 178.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.0 m -69.93 134.11 48.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.017 -0.538 . . . . 30.75 109.786 174.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -77.89 123.1 26.35 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.888 0.375 . . . . 28.739999999999998 111.215 -176.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 35.4 m80 -71.78 93.98 1.35 Allowed 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.465 -0.569 . . . . 29.030000000000001 109.465 177.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 5.1 p80 -79.38 91.32 5.06 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.694 0.759 . . . . 26.800000000000001 110.975 -177.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 35.4 t-80 -75.51 93.06 2.94 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.355 -0.839 . . . . 24.5 109.613 176.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 28.4 p80 -59.11 141.2 54.74 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.9 -0.591 . . . . 24.210000000000001 111.604 -178.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 44.1 p-80 -127.98 144.87 51.11 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.967 -0.753 . . . . 20.899999999999999 108.967 175.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.5 m -70.07 139.82 52.67 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.624 0.25 . . . . 20.109999999999999 110.546 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 43.3 m -73.61 85.41 1.59 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.46 0.647 . . . . 17.379999999999999 110.001 176.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -172.34 61.62 0.15 Allowed Glycine 0 N--CA 1.445 -0.718 0 CA-C-N 115.041 -0.981 . . . . 16.75 110.671 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -108.37 -34.55 6.76 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.441 0.639 . . . . 19.629999999999999 109.647 -175.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.423 ' H ' ' CD ' ' A' ' 15' ' ' GLU . 0.6 OUTLIER -91.21 1.01 57.42 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.154 -0.93 . . . . 14.57 111.066 -178.886 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.497 ' C ' HD21 ' A' ' 16' ' ' ASN . 0.2 OUTLIER -72.22 -1.51 15.44 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.798 0.332 . . . . 16.100000000000001 111.596 -178.162 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.49 HD13 ' ND2' ' A' ' 16' ' ' ASN . 6.9 mp -80.88 -17.84 49.28 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.046 0.451 . . . . 16.719999999999999 110.31 174.647 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -89.79 91.82 8.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.166 0.508 . . . . 15.609999999999999 111.069 -178.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -106.62 9.51 31.33 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.688 -0.687 . . . . 11.970000000000001 109.738 176.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -74.25 -7.97 54.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.209 -0.905 . . . . 10.890000000000001 110.813 179.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -68.51 101.94 0.82 Allowed Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.956 -0.64 . . . . 7.0 111.971 179.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 60.8 m80 -84.15 170.69 13.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.675 0.274 . . . . 6.5999999999999996 110.417 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 48.3 tpp -66.95 96.31 0.42 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.892 -0.595 . . . . 4.7999999999999998 110.381 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 37.8 m -84.41 143.27 29.54 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.852 -0.613 . . . . 2.2000000000000002 109.788 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 11.2 tp -61.24 -32.03 51.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.611 0.243 . . . . 1.8200000000000001 110.899 -176.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.448 ' HA ' ' OE1' ' A' ' 26' ' ' GLN . 6.4 tp60 -63.14 -37.2 86.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.97 0.414 . . . . 1.99 110.683 179.392 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -71.59 -33.8 69.33 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.226 -0.443 . . . . 2.9300000000000002 110.054 177.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.403 HG11 ' HE3' ' A' ' 32' ' ' LYS . 62.2 t -61.45 -50.91 78.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.968 -0.56 . . . . 1.6299999999999999 110.194 177.27 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.482 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.7 mp -58.39 -50.21 79.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.804 -0.635 . . . . 1.3300000000000001 110.149 176.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -53.46 -52.03 60.81 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.727 -0.669 . . . . 2.2000000000000002 111.579 -178.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.8 -42.22 77.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 1.6699999999999999 112.138 -173.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.403 ' HE3' HG11 ' A' ' 28' ' ' VAL . 8.4 mtmp? -66.88 -45.71 77.19 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.595 -0.442 . . . . 2.5299999999999998 111.564 -175.127 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 4.5 pp -72.31 -28.27 62.97 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.197 -0.601 . . . . 1.24 110.999 177.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.437 ' N ' HD11 ' A' ' 33' ' ' LEU . 46.3 t -66.0 -41.82 90.56 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.982 0.42 . . . . 1.6599999999999999 109.901 175.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.7 m -66.93 -27.65 67.65 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.111 0.482 . . . . 0.79000000000000004 110.686 179.021 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.447 ' HB1' HG12 ' A' ' 79' ' ' ILE . . . -77.15 -53.91 7.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.807 -0.633 . . . . 1.24 111.87 -178.613 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.3 mt -86.79 -26.38 24.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.439 -0.346 . . . . 1.49 111.465 -174.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.2 tttp 56.67 75.12 0.6 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.771 -0.65 . . . . 3.8500000000000001 110.964 -176.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.622 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 23.5 Cg_endo -94.45 144.47 1.66 Allowed 'Trans proline' 0 N--CA 1.448 -1.154 0 C-N-CA 123.29 2.66 . . . . 0.67000000000000004 112.566 179.141 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 23.9 p -80.58 -23.76 39.66 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.424 0.63 . . . . 1.3700000000000001 109.489 174.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.755 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 76.5 t80 -139.25 125.21 19.81 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.005 -0.998 . . . . 0.83999999999999997 109.248 175.272 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -142.23 118.73 10.94 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.323 -0.621 . . . . 2.1899999999999999 109.323 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -131.55 131.89 43.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.518 -0.31 . . . . 2.23 110.908 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -89.55 115.59 27.07 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.975 -0.75 . . . . 2.23 108.975 176.004 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 44.6 t -107.17 132.21 55.19 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.024 0.44 . . . . 1.72 111.502 -175.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.28 100.93 0.38 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.515 -0.766 . . . . 1.8300000000000001 109.255 172.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.496 ' HD3' ' HB3' ' A' ' 56' ' ' ASP . 27.4 tptt -89.69 -69.01 0.74 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.013 0.435 . . . . 3.2400000000000002 109.985 -176.002 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 16.8 t -82.91 112.07 19.37 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.769 -0.65 . . . . 3.3799999999999999 109.653 -179.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.0 p -65.19 129.25 39.03 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.251 0.548 . . . . 5.1600000000000001 111.169 -176.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 155.13 -138.89 6.32 Favored Glycine 0 N--CA 1.444 -0.767 0 CA-C-N 115.207 -0.906 . . . . 3.3300000000000001 111.205 -177.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.5 t -86.79 -14.46 42.2 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.022 0.439 . . . . 4.6299999999999999 110.08 177.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 128.77 55.43 0.11 Allowed Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.845 -0.693 . . . . 2.7599999999999998 111.913 178.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.4 m -68.52 -42.07 79.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.214 0.531 . . . . 3.98 110.912 -179.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.0 m -140.01 127.24 21.16 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.79 -0.641 . . . . 2.04 110.142 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -111.55 132.42 54.54 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.719 -0.845 . . . . 1.3 108.719 175.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.496 ' HB3' ' HD3' ' A' ' 47' ' ' LYS . 35.1 t70 -115.56 125.94 53.6 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.947 -0.39 . . . . 1.3500000000000001 109.947 -175.183 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.15 115.95 31.1 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.199 0.523 . . . . 1.23 111.273 -174.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 62.0 t -78.09 111.85 15.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.391 -0.822 . . . . 1.1799999999999999 109.061 174.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.531 ' CG1' ' HA ' ' A' ' 94' ' ' CYS . 0.9 OUTLIER -105.16 133.89 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-O 121.234 0.54 . . . . 1.9399999999999999 110.356 -177.559 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.755 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 96.9 t -124.91 101.48 8.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 N-CA-C 108.618 -0.882 . . . . 1.3700000000000001 108.618 172.125 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.622 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 37.1 t -151.7 154.97 37.37 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.186 -0.461 . . . . 1.3100000000000001 111.376 -173.211 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.46 -18.97 65.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.935 -0.575 . . . . 1.6699999999999999 110.519 174.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -63.42 -1.93 1.34 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 122.804 0.442 . . . . 1.8100000000000001 112.022 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.586 ' HD2' HG21 ' A' ' 96' ' ' THR . 51.6 t80 -109.69 -7.14 15.12 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.983 -0.448 . . . . 3.8700000000000001 111.528 179.643 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -75.5 -18.2 59.9 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.688 -0.405 . . . . 2.1400000000000001 111.606 -171.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.481 ' O ' ' HG2' ' A' ' 67' ' ' LYS . 8.7 m-20 -75.59 -15.41 60.36 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.828 -0.169 . . . . 2.0299999999999998 110.847 175.49 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 66' ' ' ASP . 62.3 pttt 53.6 13.85 0.53 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.759 1.224 . . . . 3.8599999999999999 113.21 178.482 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -78.82 125.32 29.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.209 0.528 . . . . 2.4900000000000002 111.276 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 28.0 tp -69.7 -56.67 6.57 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.311 -0.858 . . . . 2.8900000000000001 111.1 -179.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.98 -31.16 72.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.717 -0.674 . . . . 1.6000000000000001 112.125 -171.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.405 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 12.4 t70 -73.76 -45.46 51.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.056 0.455 . . . . 2.0800000000000001 110.636 -174.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 12.9 ptt180 -72.49 -31.78 65.65 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.658 -0.497 . . . . 3.4199999999999999 109.658 178.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -60.67 -50.93 71.54 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.086 -0.506 . . . . 1.3700000000000001 110.349 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -63.88 -40.46 96.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.52 -0.309 . . . . 2.1000000000000001 111.23 -178.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 89.0 mt -65.09 -50.24 66.89 Favored 'General case' 0 C--O 1.243 0.715 0 CA-C-O 121.122 0.486 . . . . 2.1299999999999999 110.754 179.529 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.54 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 47.1 t -55.65 -45.34 78.99 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.586 0 CA-C-N 115.494 -0.776 . . . . 1.4099999999999999 110.568 178.093 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -66.96 -27.37 67.4 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 121.007 -0.277 . . . . 1.21 111.431 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 96.4 m -63.19 -54.02 44.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.541 0.21 . . . . 1.3200000000000001 110.943 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.447 HG12 ' HB1' ' A' ' 36' ' ' ALA . 3.3 mp -82.19 -42.29 18.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 CA-C-O 121.63 0.728 . . . . 1.46 111.006 -178.646 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.843 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.5 mp -76.49 -0.99 25.04 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.041 -0.527 . . . . 1.3799999999999999 111.757 -176.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 51.5 tptt -51.56 -63.37 1.15 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.379 -0.6 . . . . 2.4199999999999999 109.379 169.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -74.63 -34.9 62.88 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.162 -0.472 . . . . 2.9100000000000001 110.989 176.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.843 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 5.5 tp10 -52.55 -55.4 22.48 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.387 0.613 . . . . 1.6599999999999999 111.975 -178.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 65.8 mt -50.51 -30.87 13.92 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 115.174 -0.921 . . . . 1.27 112.756 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -56.64 -23.15 39.37 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.901 0.381 . . . . 0.96999999999999997 111.098 -176.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -96.54 -1.19 47.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.132 -0.485 . . . . 1.02 111.447 -176.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 6.9 mt -127.78 142.32 44.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 110.409 -0.219 . . . . 1.3100000000000001 110.409 -177.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 86.0 t60 -69.98 -56.8 6.04 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.657 -0.417 . . . . 2.29 110.029 175.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -143.07 104.09 4.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.119 -0.491 . . . . 1.3999999999999999 110.533 179.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -92.15 133.27 35.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.15 0.5 . . . . 0.63 110.811 177.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 42.5 t -121.04 155.73 33.73 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.178 -0.675 . . . . 1.9399999999999999 109.178 177.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -143.51 138.97 29.57 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.867 0.365 . . . . 1.27 110.585 -177.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -112.47 109.06 18.43 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.562 -0.533 . . . . 2.71 109.562 174.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.531 ' HA ' ' CG1' ' A' ' 59' ' ' ILE . 37.6 m -84.01 111.65 19.48 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.829 -0.623 . . . . 2.0 110.863 -174.256 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -132.05 157.69 43.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.091 0.472 . . . . 2.6099999999999999 111.063 177.041 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.586 HG21 ' HD2' ' A' ' 64' ' ' PHE . 48.0 p -102.52 159.54 29.04 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.174 -0.467 . . . . 1.27 110.339 176.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.529 ' HG2' HD23 ' A' ' 98' ' ' LEU . 18.3 Cg_endo -60.71 -37.26 80.28 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.582 2.188 . . . . 1.0900000000000001 111.928 177.363 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.529 HD23 ' HG2' ' A' ' 97' ' ' PRO . 2.9 mm? -69.67 -32.64 71.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.109 -0.496 . . . . 2.6200000000000001 110.362 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 76.6 tt0 -72.17 -50.8 24.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.086 0.47 . . . . 2.6899999999999999 110.028 177.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.503 ' O ' ' HG2' ' A' ' 104' ' ' LYS . 82.6 t80 -62.94 -35.21 79.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.762 -0.654 . . . . 1.6100000000000001 111.607 -176.524 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.534 ' HA ' ' HD3' ' A' ' 104' ' ' LYS . 37.2 t70 -60.74 -33.0 72.26 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.873 0.368 . . . . 1.23 111.372 -178.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.64 ' HE2' ' N ' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -78.18 -22.54 48.48 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.851 0.357 . . . . 3.1499999999999999 110.638 177.729 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.486 ' O ' ' HG3' ' A' ' 106' ' ' LYS . 91.2 mt -78.66 -42.81 27.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.204 -0.453 . . . . 1.5900000000000001 111.092 -178.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.534 ' HD3' ' HA ' ' A' ' 101' ' ' ASP . 3.2 ptmt -61.62 -34.99 76.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.453 -0.34 . . . . 2.3199999999999998 111.503 179.183 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.8 m -63.48 -40.61 97.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.418 -0.356 . . . . 2.21 111.348 -178.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.486 ' HG3' ' O ' ' A' ' 103' ' ' LEU . 5.9 ptpt -86.64 -41.16 14.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.889 0.376 . . . . 4.4400000000000004 111.372 -179.3 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 87.39 -32.35 4.19 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.914 -0.66 . . . . 3.9199999999999999 112.482 179.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 49.5 m . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.61 -0.71 . . . . 4.9800000000000004 110.203 179.618 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.9 t . . . . . 0 N--CA 1.451 -0.419 0 N-CA-C 108.378 -0.971 . . . . 1.71 108.378 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.8 tp -56.7 -35.77 46.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 120.874 0.369 . . . . 1.37 110.855 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -65.91 -40.09 91.17 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.255 -0.429 . . . . 1.75 110.544 178.461 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.601 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -61.49 -40.91 96.26 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.787 -0.642 . . . . 2.5 110.447 -178.704 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 54.8 t -63.47 -55.38 23.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.9 -0.591 . . . . 1.04 110.857 -178.412 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.7 mp -58.22 -47.42 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.112 -0.494 . . . . 0.79 110.878 -179.477 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.18 -51.26 68.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.085 -0.507 . . . . 2.2 111.121 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -66.9 -34.51 77.94 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.479 -0.328 . . . . 1.67 111.33 -176.104 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.468 ' HB3' ' NZ ' ' A' ' 32' ' ' LYS . 10.1 mtpm? -63.5 -55.47 23.8 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 111.836 0.31 . . . . 2.03 111.836 -177.723 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.441 HD12 ' N ' ' A' ' 34' ' ' SER . 3.8 pp -70.46 -28.42 64.99 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.896 -0.322 . . . . 0.57 111.058 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.441 ' N ' HD12 ' A' ' 33' ' ' LEU . 19.6 t -65.37 -39.5 92.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.931 0.396 . . . . 1.29 110.558 178.81 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.1 m -67.83 -28.07 67.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.387 -0.37 . . . . 0.78 111.363 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.11 -54.96 3.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.309 -0.405 . . . . 0.64 111.961 -174.292 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.53 HD13 ' HZ ' ' A' ' 64' ' ' PHE . 65.9 mt -87.94 -16.72 33.04 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.707 0.289 . . . . 0.94 111.06 -175.263 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.5 mttp 49.55 76.39 0.55 Allowed Pre-proline 0 C--O 1.235 0.324 0 CA-C-N 115.348 -0.842 . . . . 3.36 112.635 178.284 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.479 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 51.5 Cg_endo -89.27 126.68 1.64 Allowed 'Trans proline' 0 N--CA 1.447 -1.259 0 C-N-CA 122.687 2.258 . . . . 0.63 111.769 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.3 p -63.16 -25.54 68.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.118 0.485 . . . . 0.73 110.966 177.318 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.693 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 89.3 t80 -141.76 141.62 33.23 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.617 -0.72 . . . . 0.76 109.491 175.639 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 45.7 tp -142.16 116.83 9.76 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.977 -0.379 . . . . 1.55 109.977 178.296 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.506 ' HB3' ' HB ' ' A' ' 58' ' ' VAL . 5.7 tp10 -105.47 130.05 53.63 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 110.036 -0.357 . . . . 2.23 110.036 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.9 mp -118.44 115.8 25.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.116 0.484 . . . . 1.72 110.82 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 44.1 t -122.13 144.04 32.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.861 -0.609 . . . . 1.08 110.108 179.176 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -72.67 115.01 11.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.134 0.492 . . . . 1.83 110.602 176.108 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.516 ' O ' ' HB2' ' A' ' 54' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.319 -0.734 0 N-CA-C 107.794 -1.187 . . . . 2.76 107.794 174.481 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.516 ' HB2' ' O ' ' A' ' 47' ' ' LYS . 14.1 m . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 108.836 -0.801 . . . . 1.71 108.836 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -111.47 132.84 54.19 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.12 0.486 . . . . 1.15 110.774 -173.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.469 ' HB2' ' CB ' ' A' ' 47' ' ' LYS . 4.2 t70 -117.48 108.72 15.86 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.319 -0.993 . . . . 1.35 108.319 175.859 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.488 ' HA ' ' O ' ' A' ' 43' ' ' GLU . . . -111.15 124.91 53.13 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.14 0.495 . . . . 0.51 112.08 -171.462 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.506 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 58.6 t -90.02 116.74 31.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.641 -0.709 . . . . 0.55 109.421 174.365 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.66 HG12 ' HA ' ' A' ' 94' ' ' CYS . 2.5 pt -97.42 145.29 9.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 121.146 0.498 . . . . 1.18 110.77 -176.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.693 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 89.1 t -131.63 97.66 3.0 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 115.502 -0.772 . . . . 0.58 108.939 174.509 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.479 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 41.9 t -144.12 138.64 28.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.321 0.582 . . . . 0.84 112.1 -174.207 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.573 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 3.8 m120 -67.66 -19.17 65.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.323 -0.853 . . . . 1.67 111.391 174.368 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -61.69 -22.35 65.25 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.364 0.602 . . . . 1.81 110.581 -178.356 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.647 ' CD2' ' HD2' ' A' ' 72' ' ' ARG . 13.5 m-85 -102.44 -5.91 23.55 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.943 -0.571 . . . . 3.19 112.156 -174.518 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.573 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -80.92 -10.09 59.76 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.946 0.403 . . . . 2.14 110.69 -176.85 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -75.79 -9.3 58.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.82 -0.627 . . . . 2.03 109.817 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.449 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 2.7 mmmp? 68.55 18.6 8.88 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.169 -0.923 . . . . 3.31 111.942 175.714 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.794 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 31.1 mmmt -69.5 89.79 0.52 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.347 -0.388 . . . . 1.99 109.995 174.795 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -63.77 -59.67 4.26 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.742 0.306 . . . . 2.33 110.476 -175.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.426 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.19 -31.18 71.4 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.188 -0.46 . . . . 1.09 111.31 -177.327 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.794 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 27.0 t70 -73.91 -43.95 56.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.498 -0.319 . . . . 2.08 110.788 -175.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.647 ' HD2' ' CD2' ' A' ' 64' ' ' PHE . 26.8 ptt180 -69.14 -31.93 70.94 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.297 -0.561 . . . . 2.93 109.76 177.668 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -65.03 -49.72 69.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.152 -0.477 . . . . 1.21 110.515 177.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.631 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 3.0 ptm180 -63.59 -40.93 98.21 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.52 -0.309 . . . . 1.67 110.767 -179.243 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.26 -50.34 68.33 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.631 0.253 . . . . 1.48 110.935 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 72' ' ' ARG . 49.2 t -56.58 -47.03 82.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.304 -0.407 . . . . 0.82 110.94 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -66.56 -29.93 70.12 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 121.097 -0.241 . . . . 1.14 111.619 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 85.4 m -67.61 -43.91 79.31 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.865 0.364 . . . . 0.69 111.307 -179.094 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.3 mp -81.29 -42.9 20.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 CA-C-O 121.331 0.586 . . . . 0.77 110.623 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.755 ' HA ' ' CB ' ' A' ' 83' ' ' GLU . 10.9 mp -73.27 -3.64 28.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.148 -0.478 . . . . 0.78 111.129 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 45.6 tptt -51.8 -63.29 1.18 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.534 -0.543 . . . . 1.93 109.534 169.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -75.16 -33.28 61.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.958 0.409 . . . . 2.91 110.346 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.755 ' CB ' ' HA ' ' A' ' 80' ' ' LEU . 1.9 tp10 -54.02 -56.23 19.93 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.751 0.786 . . . . 1.66 111.727 -176.178 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 57.5 mt -50.25 -30.95 12.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.243 -1.344 . . . . 0.58 112.882 177.374 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -54.76 -24.43 22.43 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.031 0.378 . . . . 0.92 111.608 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -102.6 -0.02 32.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.553 -0.294 . . . . 1.02 111.75 -176.187 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 8.3 mt -126.13 139.88 50.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.683 0.278 . . . . 0.77 110.383 -176.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 50.0 t60 -70.37 -42.19 72.11 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.804 -0.443 . . . . 1.85 109.804 175.674 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.418 ' O ' ' HB3' ' A' ' 54' ' ' SER . . . -157.54 111.6 2.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.159 -0.473 . . . . 0.78 110.629 177.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -103.11 121.87 43.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.387 -0.369 . . . . 0.63 110.504 176.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.3 m -111.33 147.32 35.37 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.754 -0.657 . . . . 1.27 109.494 177.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -135.82 142.17 44.81 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.013 0.435 . . . . 0.64 111.433 -178.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -109.49 112.98 25.39 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.291 -0.633 . . . . 2.23 109.291 173.196 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.66 ' HA ' HG12 ' A' ' 59' ' ' ILE . 5.7 p -83.54 116.22 22.47 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.923 -0.581 . . . . 1.38 111.224 -175.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -143.62 166.95 23.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.29 0.566 . . . . 1.98 111.372 176.065 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.527 HG21 ' HB3' ' A' ' 65' ' ' GLU . 22.0 p -113.87 163.32 19.07 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 115.544 -0.753 . . . . 0.76 110.901 -179.19 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.95 -24.0 78.52 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.759 2.306 . . . . 0.72 111.899 177.396 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -66.44 -49.35 67.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.844 -0.616 . . . . 2.08 110.032 178.074 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.546 ' HA ' ' HD3' ' A' ' 102' ' ' LYS . 34.4 mt-10 -76.96 -30.44 56.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.071 -0.513 . . . . 2.69 110.682 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 52.0 t80 -66.88 -41.45 87.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.435 -0.348 . . . . 1.46 110.976 177.456 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -57.13 -38.14 73.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.027 0.442 . . . . 1.23 110.77 178.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.546 ' HD3' ' HA ' ' A' ' 99' ' ' GLU . 15.2 mtpp -58.07 -48.05 81.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.852 -0.613 . . . . 2.66 110.558 178.581 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 53.2 mt . . . . . 0 C--N 1.323 -0.561 0 CA-C-N 115.85 -0.614 . . . . 1.31 111.682 -175.85 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.575 ' O ' HG23 ' A' ' 28' ' ' VAL . 21.3 t . . . . . 0 N--CA 1.453 -0.319 0 N-CA-C 109.591 -0.522 . . . . 1.71 109.591 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.0 tp -57.06 -38.65 61.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 O-C-N 123.242 0.339 . . . . 1.37 111.088 -176.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -61.68 -43.86 98.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.928 0.394 . . . . 1.75 110.279 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -71.27 -26.3 62.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.122 -0.49 . . . . 2.5 111.01 -177.373 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.575 HG23 ' O ' ' A' ' 24' ' ' CYS . 91.2 t -61.76 -53.86 42.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.367 -0.379 . . . . 1.04 110.19 176.201 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.482 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.8 mp -61.17 -43.76 97.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.784 -0.644 . . . . 0.79 110.228 178.424 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -52.67 -51.81 58.56 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 116.028 -0.533 . . . . 2.2 111.769 178.001 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -69.69 -30.93 68.7 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.283 0.563 . . . . 1.67 110.684 -177.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 31.1 tttm -68.57 -54.48 16.35 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.378 -0.828 . . . . 2.03 111.065 -176.149 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 3.9 pp -71.92 -27.04 62.55 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 120.757 -0.377 . . . . 0.57 111.048 176.768 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.466 ' N ' HD12 ' A' ' 33' ' ' LEU . 44.3 t -61.93 -44.04 97.6 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-O 120.805 0.336 . . . . 1.29 110.226 176.301 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.2 m -64.22 -27.37 69.01 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.327 -0.397 . . . . 0.78 110.965 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.86 -54.43 5.6 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.093 0.405 . . . . 0.64 112.093 -177.595 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.0 mt -97.07 -35.59 10.77 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.867 0.365 . . . . 0.94 111.725 -174.245 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.49 ' HD3' ' HA ' ' A' ' 38' ' ' LYS . 31.8 mmtt 58.15 87.29 0.14 Allowed Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.364 -0.835 . . . . 3.36 112.862 -177.631 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.817 ' HB3' HG12 ' A' ' 59' ' ' ILE . 73.7 Cg_endo -82.91 137.62 8.77 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 122.62 2.213 . . . . 0.63 111.34 171.951 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 33.4 p -77.54 -23.89 50.01 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.42 0.629 . . . . 0.73 109.695 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.623 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 83.9 t80 -136.3 124.05 22.5 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.123 -0.944 . . . . 0.76 109.176 172.656 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.419 HD12 ' O ' ' A' ' 58' ' ' VAL . 56.7 tp -134.9 113.86 11.97 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.432 -0.349 . . . . 1.55 110.337 -177.773 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -120.37 124.85 46.54 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.385 -0.371 . . . . 2.23 110.974 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 67.1 mt -86.4 122.16 29.97 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.172 0.511 . . . . 1.72 110.787 175.137 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 67.6 t -106.96 111.09 34.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.479 -0.782 . . . . 1.08 109.05 175.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -69.28 102.11 1.65 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.994 -0.548 . . . . 1.83 109.977 -177.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 36.2 mmtm . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 116.046 -0.525 . . . . 2.76 111.05 -177.568 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.3 m . . . . . 0 N--CA 1.452 -0.372 0 CA-C-O 120.906 0.384 . . . . 1.71 110.993 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -111.43 138.69 47.61 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.091 -0.504 . . . . 1.15 110.384 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -116.54 123.02 46.38 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.24 -0.652 . . . . 1.35 109.24 176.157 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.98 115.74 30.74 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.863 0.363 . . . . 0.51 110.899 -176.796 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.789 HG22 ' HE2' ' A' ' 93' ' ' LYS . 38.3 t -81.07 110.95 17.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 108.621 -0.881 . . . . 0.55 108.621 173.643 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.817 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -111.53 107.7 23.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 CA-C-O 121.679 0.752 . . . . 1.18 110.485 -174.011 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.623 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 58.0 t -104.58 106.64 20.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 CA-C-N 114.94 -1.027 . . . . 0.58 108.464 174.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.589 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 32.7 t -142.84 147.43 35.41 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.755 0.65 . . . . 0.84 112.755 -170.243 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.473 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 5.5 t30 -64.09 -22.19 66.83 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 114.988 -1.006 . . . . 1.67 110.829 173.258 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -63.35 -35.62 81.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.188 0.518 . . . . 1.81 110.417 -177.328 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.415 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 27.2 t80 -100.49 12.04 38.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.318 0.58 . . . . 3.19 110.118 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.473 ' HB3' ' O ' ' A' ' 62' ' ' ASN . 2.2 tp10 -81.31 -28.55 34.55 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 108.087 -1.079 . . . . 2.14 108.087 176.232 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.599 ' OD2' ' HG3' ' A' ' 68' ' ' LYS . 21.0 t70 -57.32 -41.13 79.33 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 108.293 -1.003 . . . . 2.03 108.293 166.203 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.0 ttpm? 75.59 25.02 1.25 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 114.476 -1.238 . . . . 3.31 113.161 161.12 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.599 ' HG3' ' OD2' ' A' ' 66' ' ' ASP . 36.7 mtmm -74.76 122.53 23.44 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 121.97 -0.456 . . . . 1.99 109.959 169.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.5 pp -74.0 -32.18 63.28 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.772 -0.371 . . . . 2.33 110.953 -175.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.504 HD13 ' HB3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -67.72 -30.81 70.4 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.038 0.447 . . . . 1.09 110.417 177.32 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.469 ' HB2' ' HE2' ' A' ' 68' ' ' LYS . 36.0 t70 -72.62 -36.91 68.16 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.155 0.502 . . . . 2.08 109.658 179.49 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.415 ' HB2' ' CE1' ' A' ' 64' ' ' PHE . 48.3 ttt-85 -57.77 -47.25 83.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.496 -0.775 . . . . 2.93 109.563 172.309 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -57.22 -54.46 46.5 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.143 -0.935 . . . . 1.21 111.28 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.428 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 13.2 ptm180 -70.7 -46.42 63.15 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.285 0.476 . . . . 1.67 112.285 -172.871 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 75' ' ' LEU . 27.3 mt -63.08 -45.97 89.63 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 111.759 0.281 . . . . 1.48 111.759 -176.738 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.536 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 58.7 t -58.05 -48.25 84.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.57 -0.286 . . . . 0.82 110.487 179.002 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -66.58 -31.7 72.57 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.687 -0.405 . . . . 1.14 111.564 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 99.2 m -61.71 -61.41 2.53 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.655 0.242 . . . . 0.69 111.655 -178.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.5 mp -75.95 -43.8 38.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-O 121.071 0.463 . . . . 0.77 110.833 -176.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.802 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.4 mp -77.65 -7.55 56.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.903 -0.59 . . . . 0.78 112.338 -171.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -50.13 -62.55 1.51 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.277 0.56 . . . . 1.93 109.9 171.361 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -75.15 -33.52 61.53 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.448 -0.796 . . . . 2.91 110.708 177.446 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.802 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.3 tp10 -56.29 -53.53 56.21 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.477 0.656 . . . . 1.66 112.026 -176.261 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.672 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 66.3 mt -50.72 -30.44 13.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.711 -1.131 . . . . 0.58 112.505 179.662 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -53.5 -27.36 25.07 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.046 0.451 . . . . 0.92 111.038 -178.358 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -87.0 -6.78 58.64 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.804 -0.634 . . . . 1.02 111.701 -175.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.476 HD12 ' HB2' ' A' ' 90' ' ' PHE . 3.2 mt -125.52 160.36 31.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 109.969 -0.382 . . . . 0.77 109.969 -176.887 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -79.36 -54.82 5.56 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.421 -0.585 . . . . 1.85 109.421 174.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -145.26 115.59 7.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.828 -0.624 . . . . 0.78 110.176 177.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' PHE . . . . . 0.476 ' HB2' HD12 ' A' ' 87' ' ' ILE . 86.2 t80 -108.4 129.19 55.26 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.161 0.505 . . . . 0.63 110.605 177.849 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 38.2 t -115.02 146.76 40.93 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.267 -0.879 . . . . 1.27 109.25 177.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -129.3 130.69 46.48 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.929 0.395 . . . . 0.64 110.417 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.789 ' HE2' HG22 ' A' ' 58' ' ' VAL . 2.3 ttmm -113.7 109.01 17.9 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.864 -0.791 . . . . 2.23 108.864 176.613 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.514 ' HA ' HG23 ' A' ' 59' ' ' ILE . 13.2 p -92.16 140.9 29.17 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.934 0.397 . . . . 1.38 111.358 -172.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.617 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 8.7 t60 -153.65 154.43 34.16 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.939 -0.573 . . . . 1.98 109.712 177.414 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.407 ' CG2' ' HA ' ' A' ' 65' ' ' GLU . 1.3 p -96.6 148.79 34.97 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 121.042 0.449 . . . . 0.76 112.093 -177.296 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -67.87 -35.34 21.31 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 123.255 2.637 . . . . 0.72 113.075 -176.061 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' A' ' 98' ' ' LEU . 4.4 mm? -59.4 -48.22 82.46 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.112 0.482 . . . . 2.08 110.225 179.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -66.24 -33.78 76.52 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.623 -0.717 . . . . 2.69 111.012 177.375 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 49.7 t80 -69.83 -33.99 73.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.469 -0.332 . . . . 1.46 111.4 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -58.08 -35.15 70.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.94 0.4 . . . . 1.23 111.087 -178.655 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.704 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -74.91 -29.35 60.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.907 0.384 . . . . 2.66 110.378 178.528 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 89.7 mt . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 115.941 -0.572 . . . . 1.31 110.67 179.19 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 32.3 m . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 120.534 0.206 . . . . 1.71 110.74 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.3 tp -57.2 -34.04 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-O 121.178 0.513 . . . . 1.37 110.925 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -65.52 -38.89 91.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.104 -0.498 . . . . 1.75 110.922 178.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.718 ' HA ' ' HE3' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -68.4 -46.57 69.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.093 -0.503 . . . . 2.5 111.193 -175.615 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.533 ' O ' ' HG2' ' A' ' 32' ' ' LYS . 5.3 p -64.87 -46.04 93.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 C-N-CA 120.833 -0.347 . . . . 1.04 111.163 -177.445 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.47 HD12 HG13 ' A' ' 28' ' ' VAL . 1.7 mp -60.71 -47.62 92.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-O 121.033 0.444 . . . . 0.79 110.721 178.577 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.64 -42.02 91.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.326 -0.397 . . . . 2.2 110.77 -178.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -68.04 -35.4 78.2 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.167 -0.47 . . . . 1.67 111.423 -175.558 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 28' ' ' VAL . 74.1 mmtt -65.06 -55.61 17.84 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.935 0.398 . . . . 2.03 111.067 -178.714 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.497 HD12 ' N ' ' A' ' 34' ' ' SER . 3.3 pp -71.81 -28.9 63.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.126 -0.488 . . . . 0.57 112.135 -174.758 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.497 ' N ' HD12 ' A' ' 33' ' ' LEU . 69.7 m -69.23 -43.05 74.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.769 0.319 . . . . 1.29 110.97 179.56 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.7 m -71.3 -27.45 63.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.1 0.476 . . . . 0.78 111.076 -178.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.65 -54.94 4.0 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.032 0.382 . . . . 0.64 112.032 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.1 mt -81.85 -32.04 31.33 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.848 0.314 . . . . 0.94 111.848 -173.208 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm 65.16 74.77 0.38 Allowed Pre-proline 0 N--CA 1.468 0.456 0 O-C-N 123.595 0.559 . . . . 3.36 110.99 -175.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.6 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 63.0 Cg_endo -88.66 134.76 2.83 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 122.289 1.993 . . . . 0.63 112.374 176.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 30.4 p -68.86 -30.56 69.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.276 0.56 . . . . 0.73 109.64 175.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.677 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 86.3 t80 -141.91 134.27 27.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.325 -0.852 . . . . 0.76 109.262 174.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.414 HD22 ' HA ' ' A' ' 42' ' ' LEU . 1.4 tm? -142.24 126.16 17.19 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.547 -0.538 . . . . 1.55 109.547 -178.69 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -137.48 127.79 26.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.889 0.375 . . . . 2.23 110.934 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.412 HD22 ' N ' ' A' ' 44' ' ' LEU . 2.5 mm? -90.61 115.76 27.98 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.368 -0.604 . . . . 1.72 109.368 177.289 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 52.5 t -109.08 118.25 56.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.901 0.382 . . . . 1.08 110.769 -178.783 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -91.19 123.64 34.79 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.108 -0.701 . . . . 1.83 109.108 173.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 60.6 tttp . . . . . 0 C--N 1.322 -0.591 0 CA-C-O 120.791 0.329 . . . . 2.76 110.857 -179.752 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 62.3 m . . . . . 0 N--CA 1.45 -0.443 0 N-CA-C 109.109 -0.701 . . . . 1.71 109.109 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -111.39 137.6 48.96 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.597 -0.274 . . . . 1.15 110.82 -176.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -102.18 110.23 22.13 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.754 -1.202 . . . . 1.35 107.754 168.448 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.77 117.53 34.25 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 120.899 0.38 . . . . 0.51 111.268 -171.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.7 t -73.39 111.27 7.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 109.026 -0.731 . . . . 0.55 109.026 176.285 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -106.87 107.81 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 CA-C-O 121.774 0.797 . . . . 1.18 109.571 -178.313 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.677 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 58.7 t -108.21 103.97 16.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.108 -0.951 . . . . 0.58 108.971 177.087 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.6 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 29.0 t -145.26 153.27 41.13 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.986 0.422 . . . . 0.84 111.291 -175.002 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.743 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 22.9 m120 -67.44 -19.21 65.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.486 -0.779 . . . . 1.67 110.477 175.083 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -63.65 -18.97 64.5 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.236 0.541 . . . . 1.81 110.384 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.612 ' HD2' HG23 ' A' ' 96' ' ' THR . 62.9 t80 -93.46 -19.8 20.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 3.19 111.561 -178.432 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.743 ' HG2' ' O ' ' A' ' 62' ' ' ASN . 11.9 pt-20 -71.23 -20.06 62.29 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.627 -0.429 . . . . 2.14 110.474 -176.318 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.633 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . 17.2 m-20 -69.15 -20.48 64.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.029 -0.532 . . . . 2.03 110.581 175.473 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.402 ' HD3' ' HA ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER 64.11 19.74 11.89 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.453 -0.794 . . . . 3.31 110.777 177.222 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.633 ' HG2' ' HB3' ' A' ' 66' ' ' ASP . 31.3 mmmt -79.54 102.63 8.95 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.907 -0.588 . . . . 1.99 110.323 -178.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.411 HD12 ' N ' ' A' ' 70' ' ' LEU . 3.7 pp -67.55 -44.22 78.8 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.324 -0.398 . . . . 2.33 110.767 -177.583 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.431 ' CD1' ' H ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.73 -31.24 71.04 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.49 -0.323 . . . . 1.09 111.254 -178.972 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.703 ' HA ' ' HD2' ' A' ' 74' ' ' ARG . 4.8 m-20 -73.55 -44.77 56.68 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 121.094 -0.242 . . . . 2.08 111.345 -178.819 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 18.3 ptt180 -67.89 -31.93 72.07 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.909 -0.716 . . . . 2.93 109.82 176.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -64.03 -50.97 66.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.071 -0.513 . . . . 1.21 110.521 176.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.703 ' HD2' ' HA ' ' A' ' 71' ' ' ASP . 5.0 ptm180 -63.57 -39.55 94.68 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.399 -0.364 . . . . 1.67 110.836 -177.255 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -66.48 -51.84 52.48 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.723 0.297 . . . . 1.48 111.046 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.705 HG13 HD22 ' A' ' 80' ' ' LEU . 45.6 t -57.74 -45.69 86.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.065 -0.516 . . . . 0.82 110.978 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.555 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 12.7 m120 -62.73 -42.01 99.45 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.475 -0.49 . . . . 1.14 111.262 -178.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.467 ' HB ' HD12 ' A' ' 79' ' ' ILE . 89.3 m -58.76 -54.67 44.44 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.113 0.412 . . . . 0.69 112.113 -175.736 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.467 HD12 ' HB ' ' A' ' 78' ' ' THR . 4.3 mp -88.01 -48.51 15.04 Favored 'Isoleucine or valine' 0 C--O 1.242 0.663 0 CA-C-O 121.643 0.735 . . . . 0.77 111.016 -175.854 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.79 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 7.7 mp -73.31 -4.37 32.82 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.654 -0.703 . . . . 0.78 111.668 -173.601 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.555 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 17.6 tppt? -55.72 -60.0 4.07 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.358 -0.608 . . . . 1.93 109.358 168.603 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.453 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 6.9 mm-40 -67.72 -32.94 73.91 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.65 -0.705 . . . . 2.91 110.261 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.642 ' CB ' ' HA ' ' A' ' 80' ' ' LEU . 2.6 tp10 -54.59 -55.35 30.35 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.815 -0.63 . . . . 1.66 111.054 176.187 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.79 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 56.3 mt -51.03 -30.58 15.88 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.273 -0.876 . . . . 0.58 112.46 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.453 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 23.1 mm-40 -54.41 -25.52 25.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.64 0.257 . . . . 0.92 111.436 -176.471 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -106.63 8.28 31.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.716 0.293 . . . . 1.02 111.326 -177.213 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 11.2 mt -129.35 155.81 41.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 109.635 -0.506 . . . . 0.77 109.635 -178.662 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -86.9 -61.11 1.8 Allowed 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.414 -0.514 . . . . 1.85 109.778 175.442 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -137.85 95.15 2.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.056 0.455 . . . . 0.78 110.99 178.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -84.68 119.63 25.47 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.018 -0.537 . . . . 0.63 110.204 176.632 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 38.0 m -112.42 157.13 21.43 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.556 -0.535 . . . . 1.27 109.556 177.287 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -134.97 137.78 43.38 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.96 0.409 . . . . 0.64 110.655 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -103.12 109.0 20.41 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.338 -0.986 . . . . 2.23 108.338 176.175 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.7 m -88.08 127.84 35.41 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 111.837 0.31 . . . . 1.38 111.837 -169.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.617 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 73.0 m-70 -148.42 160.95 42.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.108 0.48 . . . . 1.98 110.668 174.433 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.612 HG23 ' HD2' ' A' ' 64' ' ' PHE . 22.6 p -108.44 159.42 30.87 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.771 -0.65 . . . . 0.76 110.697 176.469 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -59.26 -26.35 81.5 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.594 2.196 . . . . 0.72 111.834 176.777 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -62.9 -49.78 73.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.012 -0.54 . . . . 2.08 109.961 176.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.481 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 30.5 mt-10 -60.4 -47.71 84.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.873 -0.603 . . . . 2.69 110.313 176.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -60.43 -39.16 86.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.617 -0.72 . . . . 1.46 111.087 -177.536 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -60.78 -37.68 82.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.954 0.407 . . . . 1.23 110.772 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.538 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.3 OUTLIER -71.92 -32.35 67.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.138 -0.483 . . . . 2.66 110.362 178.6 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 85.7 mt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.071 -0.513 . . . . 1.31 110.83 177.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 84.5 m . . . . . 0 C--O 1.232 0.171 0 CA-C-O 120.734 0.302 . . . . 1.71 110.884 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 10.1 tp -59.48 -30.06 43.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.931 -0.577 . . . . 1.37 110.948 -178.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -60.31 -43.41 96.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.198 -0.455 . . . . 1.75 110.437 177.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.543 ' HE3' ' HB2' ' A' ' 31' ' ' ASP . 38.8 tptt -67.5 -36.92 82.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.956 -0.565 . . . . 2.5 110.843 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 61.3 t -57.91 -52.24 60.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.061 0.457 . . . . 1.04 110.589 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.475 HG13 ' HG3' ' A' ' 83' ' ' GLU . 1.8 mp -64.35 -47.34 90.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.808 -0.633 . . . . 0.79 110.542 178.837 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -54.81 -52.05 63.9 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 116.218 -0.446 . . . . 2.2 110.892 -179.01 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.543 ' HB2' ' HE3' ' A' ' 27' ' ' LYS . 10.6 t70 -66.07 -31.09 71.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.245 -0.434 . . . . 1.67 110.971 -174.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 52.3 tptt -70.15 -55.63 8.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.517 -0.31 . . . . 2.03 111.258 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.511 HD12 ' N ' ' A' ' 34' ' ' SER . 3.9 pp -71.47 -26.32 62.66 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.894 -0.322 . . . . 0.57 111.168 -178.519 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.511 ' N ' HD12 ' A' ' 33' ' ' LEU . 9.5 t -66.77 -42.24 86.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.94 0.4 . . . . 1.29 110.132 178.225 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 26.3 m -71.59 -27.07 62.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.12 0.486 . . . . 0.78 111.027 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.79 -52.2 7.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.121 -0.49 . . . . 0.64 111.615 -178.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.2 mt -83.65 -42.09 17.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.504 -0.316 . . . . 0.94 111.23 -176.189 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 56.92 83.94 0.22 Allowed Pre-proline 0 N--CA 1.464 0.227 0 CA-C-O 121.694 0.759 . . . . 3.36 111.436 -175.027 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.618 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 74.2 Cg_endo -92.24 151.47 3.11 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 123.271 2.647 . . . . 0.63 112.991 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.7 p -76.95 -27.24 54.75 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.419 0.628 . . . . 0.73 109.958 175.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.776 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 88.6 t80 -141.73 132.52 25.74 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.336 -0.847 . . . . 0.76 109.082 173.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.55 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 60.0 tp -142.38 121.42 12.89 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 110.317 -0.253 . . . . 1.55 110.317 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -124.4 115.83 21.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.065 0.46 . . . . 2.23 110.78 178.2 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -85.94 115.5 23.6 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.135 -0.691 . . . . 1.72 109.135 174.047 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.593 HG12 ' HG3' ' A' ' 47' ' ' LYS . 19.8 t -106.13 113.56 43.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 120.913 0.387 . . . . 1.08 110.711 -177.697 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -72.66 106.08 4.53 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.937 -0.574 . . . . 1.83 110.042 175.279 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.593 ' HG3' HG12 ' A' ' 45' ' ' VAL . 56.4 mtmt . . . . . 0 C--N 1.321 -0.648 0 CA-C-N 115.816 -0.629 . . . . 2.76 109.706 177.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.426 ' HA ' ' O ' ' A' ' 89' ' ' ALA . 25.0 p . . . . . 0 N--CA 1.451 -0.39 0 CA-C-O 120.894 0.378 . . . . 1.71 110.384 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -124.96 137.69 54.25 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.176 -0.466 . . . . 1.15 110.442 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -114.68 122.04 45.23 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.831 -0.622 . . . . 1.35 109.519 178.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -107.11 115.99 31.14 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.911 0.386 . . . . 0.51 111.861 -174.169 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.2 t -83.25 111.76 19.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.19 -0.67 . . . . 0.55 109.19 173.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -111.97 115.09 48.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.646 0.736 . . . . 1.18 110.594 -174.829 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.776 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 74.7 t -114.49 106.83 21.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.013 -0.994 . . . . 0.58 109.411 176.635 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.618 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 42.5 t -146.7 153.01 39.76 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.87 0.692 . . . . 0.84 112.87 -173.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.46 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 80.4 m-20 -67.31 -22.0 65.64 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.109 -0.95 . . . . 1.67 110.518 172.842 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -65.57 -24.04 66.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.293 0.568 . . . . 1.81 110.13 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.445 ' CE1' ' HD3' ' A' ' 72' ' ' ARG . 71.0 t80 -103.06 -2.93 26.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.683 -0.69 . . . . 3.19 110.449 178.706 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.477 ' HA ' HG21 ' A' ' 96' ' ' THR . 0.9 OUTLIER -72.49 -33.18 66.77 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.584 -0.525 . . . . 2.14 109.584 -175.157 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.653 ' OD2' ' HD3' ' A' ' 68' ' ' LYS . 3.1 t70 -63.6 -14.41 51.29 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.716 -0.476 . . . . 2.03 109.716 176.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 30.6 mtmm 63.25 50.08 3.09 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.159 -0.928 . . . . 3.31 111.458 174.024 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.653 ' HD3' ' OD2' ' A' ' 66' ' ' ASP . 30.5 mmmt -89.37 96.09 10.56 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.091 -0.959 . . . . 1.99 110.527 179.256 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 46.9 tp -55.69 -64.31 0.89 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.018 -0.537 . . . . 2.33 111.741 -178.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.419 ' CD1' ' H ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -65.92 -31.01 71.69 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.211 -0.449 . . . . 1.09 111.46 -175.143 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.579 ' HB2' ' HB3' ' A' ' 68' ' ' LYS . 23.3 m-20 -73.59 -36.42 65.54 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.844 0.313 . . . . 2.08 111.844 -176.464 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.445 ' HD3' ' CE1' ' A' ' 64' ' ' PHE . 25.0 ptt85 -69.9 -32.93 71.52 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 119.891 -0.724 . . . . 2.93 109.393 175.62 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -64.73 -49.36 71.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.693 -0.685 . . . . 1.21 110.231 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.525 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 4.2 ptm180 -69.57 -40.51 76.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.864 -0.607 . . . . 1.67 111.508 -178.548 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 35.9 tp -64.96 -47.2 78.46 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.732 0.301 . . . . 1.48 110.743 -177.59 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.636 HG13 HD22 ' A' ' 80' ' ' LEU . 37.2 t -57.31 -48.32 82.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.98 -0.554 . . . . 0.82 110.701 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -61.19 -33.58 73.69 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.652 -0.249 . . . . 1.14 111.533 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 95.9 m -63.62 -56.16 17.97 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 111.804 0.298 . . . . 0.69 111.804 -178.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.2 mp -76.78 -46.84 29.62 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 CA-C-O 121.317 0.58 . . . . 0.77 110.744 -178.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.948 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 9.1 mp -73.16 -3.6 27.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.879 -0.6 . . . . 0.78 111.589 -175.139 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 48.0 tptt -50.64 -63.69 1.04 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.635 -0.506 . . . . 1.93 109.635 170.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -75.07 -36.49 61.77 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.417 -0.356 . . . . 2.91 110.622 177.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.948 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 34.4 tt0 -57.09 -45.32 83.45 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.349 -0.387 . . . . 1.66 111.895 -176.655 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 42.4 mt -56.81 -30.78 64.05 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.471 0.545 . . . . 0.58 112.471 -177.606 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -54.93 -24.57 24.3 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 120.857 0.36 . . . . 0.92 111.5 -174.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -91.44 -4.78 55.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.247 -0.433 . . . . 1.02 111.129 -175.204 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.444 HD11 HG12 ' A' ' 29' ' ' ILE . 6.0 mt -124.25 137.65 56.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.444 -0.344 . . . . 0.77 110.187 -176.755 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -75.96 -47.72 23.95 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.626 -0.509 . . . . 1.85 109.626 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.426 ' O ' ' HA ' ' A' ' 54' ' ' SER . . . -141.23 96.65 3.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.987 0.423 . . . . 0.78 111.217 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -92.79 144.61 25.12 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.167 -0.469 . . . . 0.63 110.155 175.273 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 50.0 m -135.51 162.09 33.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.188 -0.46 . . . . 1.27 109.773 175.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -144.95 148.87 34.31 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.976 0.417 . . . . 0.64 110.845 -178.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -125.34 109.09 12.36 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.798 -0.816 . . . . 2.23 108.798 174.158 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 7.9 p -93.78 124.75 37.99 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.721 0.296 . . . . 1.38 111.688 -173.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.493 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 22.1 m-70 -147.95 174.19 12.13 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 121.183 0.516 . . . . 1.98 111.122 176.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.685 ' HB ' ' HD2' ' A' ' 97' ' ' PRO . 72.2 p -116.46 164.3 18.8 Favored Pre-proline 0 C--O 1.243 0.746 0 CA-C-N 116.014 -0.539 . . . . 0.76 111.451 -177.488 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' PRO . . . . . 0.685 ' HD2' ' HB ' ' A' ' 96' ' ' THR . 14.5 Cg_endo -57.69 -20.75 44.1 Favored 'Trans proline' 0 C--O 1.219 -0.425 0 C-N-CA 122.826 2.35 . . . . 0.72 112.138 178.105 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.549 ' O ' ' HD2' ' A' ' 102' ' ' LYS . 4.0 mm? -62.46 -51.15 68.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.706 0.289 . . . . 2.08 110.236 177.62 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.574 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 3.4 mp0 -61.54 -46.32 90.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.398 . . . . 2.69 110.567 177.618 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -67.03 -42.49 84.78 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.517 -0.473 . . . . 1.46 111.75 -177.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -64.87 -33.04 75.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.855 0.36 . . . . 1.23 110.45 -178.366 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.549 ' HD2' ' O ' ' A' ' 98' ' ' LEU . 1.1 mpmm? -73.9 -20.3 60.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.518 -0.31 . . . . 2.66 110.978 177.613 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 82.1 mt . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 121.082 0.468 . . . . 1.31 109.915 174.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.492 ' O ' HG23 ' A' ' 28' ' ' VAL . 53.5 t . . . . . 0 N--CA 1.458 -0.048 0 N-CA-C 109.731 -0.47 . . . . 1.71 109.731 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.544 HD11 ' HB3' ' A' ' 86' ' ' ASN . 6.3 tp -49.49 -47.74 20.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 N-CA-C 112.19 0.441 . . . . 1.37 112.19 -175.052 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -63.72 -44.08 94.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.802 0.334 . . . . 1.75 110.322 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -64.73 -36.02 82.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.923 -0.58 . . . . 2.5 111.235 -178.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 24' ' ' CYS . 95.6 t -58.87 -55.54 22.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 N-CA-C 110.37 -0.233 . . . . 1.04 110.37 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.438 HG21 HD11 ' A' ' 87' ' ' ILE . 1.9 mp -66.19 -42.19 90.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.894 0.378 . . . . 0.79 110.586 -179.522 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -58.67 -52.2 66.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.909 -0.587 . . . . 2.2 111.534 -177.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -73.71 -31.29 63.32 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.413 -0.358 . . . . 1.67 110.81 -172.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 mmmp? -60.78 -55.57 31.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.209 -0.45 . . . . 2.03 111.578 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.411 HD12 ' N ' ' A' ' 34' ' ' SER . 4.0 pp -70.33 -26.58 63.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.73 0.3 . . . . 0.57 110.8 -179.564 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.477 ' O ' ' HA ' ' A' ' 38' ' ' LYS . 70.0 m -69.22 -34.17 74.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.765 0.316 . . . . 1.29 110.518 175.636 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.6 m -71.68 -34.32 69.58 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.909 0.385 . . . . 0.78 110.788 175.108 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.27 -54.85 7.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.012 -0.54 . . . . 0.64 111.92 -177.057 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.7 mt -89.25 -29.33 19.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.645 0.259 . . . . 0.94 111.066 -176.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.49 ' HE3' ' HB2' ' A' ' 38' ' ' LYS . 17.5 ttmt 60.99 78.78 0.3 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.737 -0.665 . . . . 3.36 111.33 176.716 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.487 ' HG2' ' HB2' ' A' ' 42' ' ' LEU . 59.1 Cg_endo -94.76 160.94 1.81 Allowed 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 123.309 2.673 . . . . 0.63 113.388 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 31.6 p -86.11 -39.82 16.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.665 0.745 . . . . 0.73 109.096 174.172 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.538 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 89.2 t80 -124.02 128.19 48.99 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.883 -1.053 . . . . 0.76 109.395 176.054 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.487 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 2.7 tm? -140.57 115.79 9.91 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.174 -0.676 . . . . 1.55 109.174 -178.212 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -130.37 132.43 45.8 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.832 0.348 . . . . 2.23 111.437 -177.348 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.8 mp -108.52 115.7 30.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.986 -0.552 . . . . 1.72 109.855 172.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.492 HG23 ' HB3' ' A' ' 56' ' ' ASP . 11.0 m -106.48 149.42 9.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.344 -0.389 . . . . 1.08 110.813 177.445 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -64.44 120.02 11.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.602 -0.726 . . . . 1.83 110.046 176.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.3 tttp . . . . . 0 C--N 1.318 -0.766 0 N-CA-C 108.885 -0.783 . . . . 2.76 108.885 178.392 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.9 m . . . . . 0 N--CA 1.452 -0.327 0 N-CA-C 109.19 -0.67 . . . . 1.71 109.19 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -131.49 147.4 52.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.043 0.449 . . . . 1.15 111.74 -172.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.492 ' HB3' HG23 ' A' ' 45' ' ' VAL . 5.6 t70 -110.4 119.03 37.91 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.343 -0.984 . . . . 1.35 108.343 173.569 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -107.03 123.02 47.59 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.117 0.484 . . . . 0.51 111.786 -175.514 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.8 t -94.41 111.45 25.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.678 -0.692 . . . . 0.55 109.203 174.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.579 HG23 ' HA ' ' A' ' 94' ' ' CYS . 0.0 OUTLIER -108.97 115.66 50.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 121.562 0.696 . . . . 1.18 110.636 -178.111 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.538 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 85.3 t -112.3 106.17 20.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.025 -0.989 . . . . 0.58 109.029 176.49 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.506 ' HB3' HD11 ' A' ' 59' ' ' ILE . 29.8 t -145.04 154.8 42.9 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.413 0.523 . . . . 0.84 112.413 -172.495 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.738 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 5.4 m-20 -66.87 -19.48 65.74 Favored 'General case' 0 C--O 1.221 -0.419 0 CA-C-N 115.334 -0.848 . . . . 1.67 110.742 171.894 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -69.27 2.17 3.14 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.088 0.471 . . . . 1.81 111.028 -178.097 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -124.59 4.25 8.26 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.754 0.312 . . . . 3.19 111.126 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.738 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.2 OUTLIER -74.88 -9.6 58.7 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 121.892 -0.505 . . . . 2.14 111.636 -176.965 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.6 p-10 -87.44 -9.98 53.17 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.968 0.414 . . . . 2.03 109.995 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.8 ttpp 64.67 25.14 13.04 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.174 -0.921 . . . . 3.31 111.32 173.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.536 ' HE3' HD11 ' A' ' 70' ' ' LEU . 30.4 mmmt -94.67 89.83 5.89 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.358 0.599 . . . . 1.99 109.617 176.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.471 HD12 ' N ' ' A' ' 70' ' ' LEU . 4.0 pp -69.19 -30.31 68.47 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.763 -0.653 . . . . 2.33 110.994 -174.126 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.536 HD11 ' HE3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -67.32 -33.88 76.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.651 0.263 . . . . 1.09 110.573 177.204 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.5 ' N ' HD22 ' A' ' 70' ' ' LEU . 25.5 t70 -74.22 -40.21 62.6 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.676 -0.49 . . . . 2.08 109.676 178.188 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -59.11 -44.44 91.99 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.425 -0.583 . . . . 2.93 109.425 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -57.7 -55.25 37.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.662 -0.699 . . . . 1.21 111.255 178.494 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.458 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 2.3 ptm180 -61.5 -41.51 97.39 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 111.784 0.29 . . . . 1.67 111.784 -175.558 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.5 mt -64.18 -50.88 66.39 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.883 0.373 . . . . 1.48 110.786 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.412 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 54.1 t -56.28 -45.7 81.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.84 -0.618 . . . . 0.82 110.92 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -64.36 -31.29 72.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.633 -0.258 . . . . 1.14 111.413 -178.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 85.2 m -66.03 -49.32 68.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.572 -0.286 . . . . 0.69 111.408 -178.172 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.1 mp -79.45 -46.0 23.27 Favored 'Isoleucine or valine' 0 C--O 1.242 0.666 0 CA-C-O 121.364 0.602 . . . . 0.77 110.701 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.838 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.8 mp -73.15 -5.46 39.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.074 -0.512 . . . . 0.78 111.711 -175.705 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -49.46 -63.94 0.95 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.215 -0.291 . . . . 1.93 110.215 171.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.472 ' O ' ' HG2' ' A' ' 85' ' ' GLN . 6.0 tp10 -75.1 -37.6 61.45 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.264 0.554 . . . . 2.91 110.507 175.85 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.838 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 3.8 tp10 -53.01 -55.15 25.78 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.412 -0.813 . . . . 1.66 112.603 -174.714 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.652 ' HG ' ' HB3' ' A' ' 80' ' ' LEU . 55.3 mt -50.4 -30.53 12.62 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.846 -1.07 . . . . 0.58 113.386 -176.731 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.472 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 19.5 mm-40 -51.16 -27.35 8.44 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.018 0.372 . . . . 0.92 111.67 -176.299 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.544 ' HB3' HD11 ' A' ' 25' ' ' ILE . 44.5 m-80 -77.74 -24.82 48.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.386 -0.37 . . . . 1.02 111.337 -178.507 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.438 HD11 HG21 ' A' ' 29' ' ' ILE . 1.8 mt -103.64 156.87 5.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.451 -0.574 . . . . 0.77 109.451 -176.265 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 39.4 t60 -98.46 -36.73 9.85 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.548 -0.461 . . . . 1.85 110.173 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -147.54 96.84 2.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.118 -0.492 . . . . 0.78 110.679 178.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -101.09 136.09 41.49 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.174 -0.466 . . . . 0.63 110.887 178.048 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 33.0 t -125.76 152.51 45.28 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.111 -0.7 . . . . 1.27 109.111 177.283 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -143.39 134.72 26.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.306 0.574 . . . . 0.64 111.505 -177.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -117.42 109.28 16.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.646 -0.706 . . . . 2.23 109.412 174.517 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.579 ' HA ' HG23 ' A' ' 59' ' ' ILE . 7.5 p -92.77 130.62 38.32 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.276 0.56 . . . . 1.38 111.555 -176.733 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.414 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 89.8 m-70 -143.88 167.08 23.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.586 -0.733 . . . . 1.98 110.017 178.174 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 39.1 p -101.63 159.15 30.26 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 116.238 -0.437 . . . . 0.76 110.006 176.552 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -58.68 -29.44 89.43 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.252 1.968 . . . . 0.72 111.166 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.85 -45.48 70.97 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.542 -0.754 . . . . 2.08 109.781 177.129 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.483 ' HA ' ' CE ' ' A' ' 102' ' ' LYS . 8.5 tp10 -61.95 -42.55 99.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.044 0.449 . . . . 2.69 110.284 177.656 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -64.66 -32.53 74.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.683 -0.689 . . . . 1.46 110.429 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -59.45 -36.49 76.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.052 -0.522 . . . . 1.23 111.266 -178.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.483 ' CE ' ' HA ' ' A' ' 99' ' ' GLU . 0.0 OUTLIER -63.64 -44.66 93.19 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.962 -0.295 . . . . 2.66 110.518 176.592 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 51.7 mt . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 116.177 -0.465 . . . . 1.31 110.948 -176.543 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 33.7 m . . . . . 0 C--O 1.235 0.34 0 N-CA-C 110.126 -0.324 . . . . 1.71 110.126 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.9 tp -56.1 -35.62 42.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 O-C-N 123.075 0.235 . . . . 1.37 110.893 -178.677 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -53.27 -49.98 65.8 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.86 0.362 . . . . 1.75 110.763 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.456 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 70.3 mmtt -71.32 -23.89 62.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.965 -0.562 . . . . 2.5 112.187 -174.525 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 46.4 t -67.22 -52.21 45.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-O 121.163 0.506 . . . . 1.04 109.844 176.19 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.416 HG13 ' OE1' ' A' ' 83' ' ' GLU . 1.8 mp -60.42 -48.56 87.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.413 -0.812 . . . . 0.79 109.905 175.713 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -56.4 -49.71 73.72 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.086 -0.961 . . . . 2.2 111.117 -178.041 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -56.33 -50.74 70.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.146 -0.479 . . . . 1.67 111.767 -177.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.3 mtmp? -63.28 -46.83 84.94 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.415 0.524 . . . . 2.03 112.415 -175.523 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.447 HD12 ' N ' ' A' ' 34' ' ' SER . 4.3 pp -71.42 -28.83 64.27 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.24 -0.584 . . . . 0.57 110.848 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.447 ' N ' HD12 ' A' ' 33' ' ' LEU . 23.1 t -69.21 -36.93 77.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.931 0.396 . . . . 1.29 110.149 177.192 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.1 m -71.6 -28.0 63.51 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.409 -0.359 . . . . 0.78 111.189 178.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.09 -54.92 5.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.313 -0.403 . . . . 0.64 112.005 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.6 mp -88.86 -25.68 22.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.601 0.238 . . . . 0.94 110.639 -177.369 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.459 ' HE2' ' HB2' ' A' ' 38' ' ' LYS . 19.9 ttmm 59.82 78.18 0.35 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.56 -0.746 . . . . 3.36 111.373 177.503 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.847 ' HA ' ' HB3' ' A' ' 61' ' ' SER . 97.4 Cg_endo -93.0 157.93 2.68 Favored 'Trans proline' 0 N--CA 1.451 -1.024 0 C-N-CA 123.177 2.585 . . . . 0.63 113.167 -177.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.0 p -89.65 -28.05 19.74 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.813 -0.63 . . . . 0.73 109.826 175.084 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.431 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 83.4 t80 -138.3 139.77 39.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.687 -0.688 . . . . 0.76 110.13 178.233 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.631 HD22 ' HA ' ' A' ' 59' ' ' ILE . 0.2 OUTLIER -142.21 116.36 9.45 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.228 -0.656 . . . . 1.55 109.228 179.135 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -114.54 127.78 55.98 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.947 0.403 . . . . 2.23 110.263 177.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -98.94 115.79 29.7 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.765 -0.652 . . . . 1.72 110.214 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.534 ' HB ' ' HB3' ' A' ' 56' ' ' ASP . 29.6 t -103.49 146.22 11.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.453 -0.794 . . . . 1.08 109.32 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -69.79 129.87 40.75 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.832 -0.433 . . . . 1.83 109.832 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.682 ' HA ' ' HE3' ' A' ' 47' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.478 0 CA-C-O 121.047 0.451 . . . . 2.76 110.044 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.0 p . . . . . 0 N--CA 1.454 -0.268 0 N-CA-C 110.288 -0.264 . . . . 1.71 110.288 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -128.3 152.45 48.12 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.251 0.548 . . . . 1.15 111.652 -175.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.534 ' HB3' ' HB ' ' A' ' 45' ' ' VAL . 13.7 t70 -113.67 134.2 54.87 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.232 -1.025 . . . . 1.35 108.232 174.086 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -125.31 120.99 32.71 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.279 0.561 . . . . 0.51 112.378 -174.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.3 t -92.52 110.98 23.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.484 -0.78 . . . . 0.55 108.996 171.352 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.631 ' HA ' HD22 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -105.4 120.47 56.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.252 -0.431 . . . . 1.18 110.576 -176.899 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.482 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 58.1 t -115.79 106.92 21.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.73 -0.668 . . . . 0.58 110.373 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.847 ' HB3' ' HA ' ' A' ' 39' ' ' PRO . 86.9 p -153.37 153.09 31.9 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.884 0.374 . . . . 0.84 111.048 -179.019 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.851 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 7.9 m120 -67.17 -19.35 65.57 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.122 -0.49 . . . . 1.67 112.078 175.239 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -52.5 -25.43 10.25 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.868 -0.52 . . . . 1.81 111.505 -177.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -100.37 -1.34 36.28 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.685 0.624 . . . . 3.19 112.685 -174.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.851 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -72.98 -15.59 61.54 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.542 -0.724 . . . . 2.14 111.669 -178.938 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -80.18 5.25 14.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.136 0.493 . . . . 2.03 110.317 -178.26 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt 62.58 26.74 15.86 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.355 -0.839 . . . . 3.31 110.803 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.615 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 71.0 mmtt -83.77 97.9 9.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.912 -0.586 . . . . 1.99 111.799 -177.161 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -73.69 -44.11 57.45 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 115.404 -0.817 . . . . 2.33 108.906 175.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.485 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.74 -33.17 74.34 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.012 -0.54 . . . . 1.09 111.503 -178.042 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.615 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 30.6 t70 -66.82 -50.29 63.08 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 109.749 -0.463 . . . . 2.08 109.749 177.363 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -57.42 -43.64 83.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.74 -0.664 . . . . 2.93 109.591 176.427 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -61.45 -50.94 70.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.658 -0.701 . . . . 1.21 111.708 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.07 -35.81 66.74 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.072 -0.251 . . . . 1.67 111.319 -174.358 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.0 mp -64.3 -50.09 69.21 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.792 0.33 . . . . 1.48 110.801 177.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.799 HG13 HD22 ' A' ' 80' ' ' LEU . 42.0 t -58.73 -47.52 88.77 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.4 0 CA-C-N 116.048 -0.524 . . . . 0.82 110.976 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.441 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 13.2 m-80 -62.47 -38.26 89.15 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.905 -0.318 . . . . 1.14 111.702 -178.255 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 87.6 m -61.4 -57.87 10.5 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.06 0.393 . . . . 0.69 112.06 -177.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.402 ' N ' HD12 ' A' ' 79' ' ' ILE . 3.7 mp -81.37 -46.09 20.47 Favored 'Isoleucine or valine' 0 C--O 1.239 0.522 0 CA-C-O 121.457 0.646 . . . . 0.77 110.839 -175.474 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.869 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.6 mp -74.55 -5.35 42.32 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.867 -0.606 . . . . 0.78 111.504 -175.204 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 20.5 tptm -49.73 -63.64 1.05 Allowed 'General case' 0 C--O 1.227 -0.117 0 N-CA-C 109.772 -0.455 . . . . 1.93 109.772 169.091 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -75.2 -30.19 60.57 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.294 0.569 . . . . 2.91 110.322 179.377 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.869 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 6.7 tp10 -56.8 -55.59 32.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.553 -0.748 . . . . 1.66 112.001 -179.191 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.658 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 75.0 mt -50.37 -30.77 13.0 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.173 -0.921 . . . . 0.58 112.634 -178.361 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 22.2 mm-40 -52.76 -30.76 34.62 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 120.954 0.407 . . . . 0.92 111.163 -176.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -96.57 5.36 50.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.199 -0.455 . . . . 1.02 111.395 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 9.1 mt -122.89 136.62 59.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.507 -0.315 . . . . 0.77 110.285 -178.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -73.38 -38.68 65.58 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.939 0.399 . . . . 1.85 110.226 179.001 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.32 102.0 1.09 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.899 -0.592 . . . . 0.78 110.416 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -94.64 140.22 30.16 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.388 -0.369 . . . . 0.63 110.221 177.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.8 m -128.83 140.19 51.82 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.335 -0.617 . . . . 1.27 109.335 176.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -129.71 133.3 46.97 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.149 0.5 . . . . 0.64 110.909 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 42.1 tptt -124.34 116.36 22.47 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.996 -0.547 . . . . 2.23 109.927 174.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.559 ' HA ' HG23 ' A' ' 59' ' ' ILE . 65.9 m -89.22 134.37 34.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.835 -0.621 . . . . 1.38 111.753 -173.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.482 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 55.9 m-70 -136.84 153.48 50.77 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.187 -0.915 . . . . 1.98 109.393 175.128 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.45 HG21 ' HB3' ' A' ' 65' ' ' GLU . 0.6 OUTLIER -93.54 150.71 39.31 Favored Pre-proline 0 C--N 1.314 -0.958 0 CA-C-N 116.282 -0.417 . . . . 0.76 110.173 174.579 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -57.09 -31.85 91.54 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.707 2.271 . . . . 0.72 112.072 -179.244 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.406 ' O ' ' HE3' ' A' ' 102' ' ' LYS . 3.1 mm? -67.64 -50.86 55.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.528 -0.76 . . . . 2.08 110.229 176.189 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.67 -27.31 66.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.541 -0.299 . . . . 2.69 111.636 -178.239 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -73.77 -32.69 63.92 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.766 -0.457 . . . . 1.46 109.766 173.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -59.5 -42.64 92.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.809 -0.632 . . . . 1.23 109.855 177.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.406 ' HE3' ' O ' ' A' ' 98' ' ' LEU . 0.0 OUTLIER -56.8 -32.57 65.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.899 -0.591 . . . . 2.66 110.985 177.12 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 70.2 mt . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 1.31 112.088 -176.248 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.511 ' O ' HG23 ' A' ' 28' ' ' VAL . 48.2 t . . . . . 0 N--CA 1.453 -0.311 0 N-CA-C 107.85 -1.167 . . . . 1.71 107.85 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 7.0 tp -59.08 -38.7 75.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.106 0.479 . . . . 1.37 110.218 177.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -63.4 -39.27 94.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.912 -0.586 . . . . 1.75 110.165 176.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -69.66 -33.83 73.14 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.98 -0.555 . . . . 2.5 110.782 -179.571 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 24' ' ' CYS . 94.8 t -57.61 -53.02 50.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 110.202 -0.296 . . . . 1.04 110.202 176.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.9 mp -68.08 -45.35 83.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.244 -0.434 . . . . 0.79 111.181 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -61.38 -52.27 65.31 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.648 0.261 . . . . 2.2 110.934 -176.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -69.56 -27.17 64.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.491 -0.322 . . . . 1.67 110.786 -176.098 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.403 ' HE2' ' HB3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -62.61 -55.65 25.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.189 -0.46 . . . . 2.03 111.172 178.489 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.431 HD12 ' N ' ' A' ' 34' ' ' SER . 3.8 pp -74.26 -30.11 61.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.538 -0.301 . . . . 0.57 111.135 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.431 ' N ' HD12 ' A' ' 33' ' ' LEU . 23.1 t -63.9 -51.59 63.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.419 -0.355 . . . . 1.29 110.837 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.0 m -71.27 -27.23 63.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.568 -0.287 . . . . 0.78 111.284 -177.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.28 -53.89 7.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.522 -0.308 . . . . 0.64 111.678 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.4 mt -83.49 -34.97 25.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.525 -0.307 . . . . 0.94 111.344 -176.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.4 mttp 62.83 85.71 0.16 Allowed Pre-proline 0 N--CA 1.464 0.233 0 CA-C-N 115.636 -0.711 . . . . 3.36 111.927 -177.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.419 ' HG2' ' HB2' ' A' ' 42' ' ' LEU . 94.4 Cg_endo -94.49 157.89 1.98 Allowed 'Trans proline' 0 N--CA 1.45 -1.067 0 C-N-CA 123.164 2.576 . . . . 0.63 112.162 175.649 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 21.5 p -78.81 -29.48 44.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.413 0.625 . . . . 0.73 109.539 176.002 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.491 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 82.9 t80 -141.68 134.49 28.7 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.068 -0.969 . . . . 0.76 109.841 175.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.419 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 1.2 tm? -140.63 112.72 7.75 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.024 -0.732 . . . . 1.55 109.024 178.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -113.37 122.32 47.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.76 -0.459 . . . . 2.23 109.76 177.255 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.457 HD11 ' HB3' ' A' ' 55' ' ' PHE . 0.1 OUTLIER -97.97 115.36 28.01 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.618 -0.512 . . . . 1.72 109.618 179.727 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 39.0 t -112.93 135.34 52.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 116.594 -0.276 . . . . 1.08 110.81 -176.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -67.72 112.86 5.05 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.211 -0.663 . . . . 1.83 109.211 171.723 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.422 ' HB3' ' OG ' ' A' ' 54' ' ' SER . 56.4 tttp . . . . . 0 C--N 1.319 -0.753 0 CA-C-N 115.784 -0.644 . . . . 2.76 110.787 -173.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.422 ' OG ' ' HB3' ' A' ' 47' ' ' LYS . 32.6 t . . . . . 0 N--CA 1.447 -0.611 0 N-CA-C 109.06 -0.718 . . . . 1.71 109.06 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.457 ' HB3' HD11 ' A' ' 44' ' ' LEU . 41.9 m-85 -124.67 132.62 53.39 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.858 0.361 . . . . 1.15 111.268 -172.599 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -115.46 114.46 25.07 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 107.423 -1.325 . . . . 1.35 107.423 171.058 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.05 117.76 34.88 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.026 0.441 . . . . 0.51 111.523 -172.038 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.8 t -80.4 110.78 16.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 108.985 -0.746 . . . . 0.55 108.985 173.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -112.65 112.6 41.14 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.663 0.744 . . . . 1.18 110.376 -176.25 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.528 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 75.3 t -110.26 108.72 26.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.082 -0.963 . . . . 0.58 108.931 175.745 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.1 t -149.04 155.04 40.17 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.359 0.6 . . . . 0.84 112.402 -172.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -66.99 -19.44 65.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 114.922 -1.035 . . . . 1.67 111.602 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 35.0 p30 -68.33 -25.39 65.09 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.852 -0.339 . . . . 1.81 111.244 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.489 ' HD2' HG23 ' A' ' 96' ' ' THR . 57.6 t80 -85.72 -12.78 50.28 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.454 0.645 . . . . 3.19 109.723 176.606 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.47 -24.64 34.14 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.299 -0.864 . . . . 2.14 109.027 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -67.49 -21.25 65.52 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.325 -0.852 . . . . 2.03 109.065 173.569 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt 65.06 23.66 12.47 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.005 -0.998 . . . . 3.31 110.966 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -90.74 89.82 7.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.956 -0.566 . . . . 1.99 110.098 177.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.4 tt -61.65 -49.83 74.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.437 -0.801 . . . . 2.33 110.733 -175.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.416 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -63.49 -31.66 72.89 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.716 0.265 . . . . 1.09 111.716 -178.586 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.65 ' O ' ' HG2' ' A' ' 74' ' ' ARG . 12.4 m-20 -73.98 -46.23 45.13 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.113 -0.235 . . . . 2.08 111.42 -179.013 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.406 ' O ' HG23 ' A' ' 76' ' ' VAL . 0.0 OUTLIER -67.3 -26.68 66.64 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.391 -0.524 . . . . 2.93 109.92 176.479 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -70.94 -48.01 55.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.066 -0.516 . . . . 1.21 110.473 176.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.65 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 7.7 ptm180 -63.69 -34.69 78.42 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.524 -0.307 . . . . 1.67 110.759 -178.322 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 95.3 mt -68.03 -50.12 57.3 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.378 -0.374 . . . . 1.48 110.2 177.393 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.582 HG13 HD22 ' A' ' 80' ' ' LEU . 43.5 t -57.4 -41.34 78.34 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 CA-C-N 116.019 -0.537 . . . . 0.82 110.781 178.0 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -62.15 -45.74 92.06 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.775 0.321 . . . . 1.14 111.203 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 59.1 m -65.52 -45.86 81.84 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.038 0.447 . . . . 0.69 111.361 -175.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 47.3 mt -77.46 -50.68 19.84 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 CA-C-O 121.464 0.65 . . . . 0.77 110.985 -176.686 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.855 ' HA ' ' CB ' ' A' ' 83' ' ' GLU . 9.7 mp -77.27 -3.97 42.53 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.636 -0.711 . . . . 0.78 111.903 -173.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.2 tptt -52.35 -63.68 1.06 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.601 -0.518 . . . . 1.93 109.601 172.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -75.53 -30.56 59.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.438 -0.347 . . . . 2.91 111.243 174.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.855 ' CB ' ' HA ' ' A' ' 80' ' ' LEU . 2.6 tp10 -54.28 -54.7 36.67 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.048 0.451 . . . . 1.66 111.585 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 66.0 mt -50.34 -30.86 13.09 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.203 -0.908 . . . . 0.58 112.317 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -54.19 -28.14 38.64 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.757 0.313 . . . . 0.92 111.128 -177.264 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -90.34 -6.89 54.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.869 0.366 . . . . 1.02 111.136 -178.043 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.531 HG21 ' HB2' ' A' ' 90' ' ' PHE . 4.2 mt -114.9 146.49 19.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.297 -0.411 . . . . 0.77 109.944 -175.27 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 60.9 t60 -95.01 -28.7 14.99 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.848 0.356 . . . . 1.85 110.079 176.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -158.68 95.58 1.32 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.18 -0.464 . . . . 0.78 110.994 178.009 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' PHE . . . . . 0.531 ' HB2' HG21 ' A' ' 87' ' ' ILE . 81.9 t80 -99.39 144.5 28.43 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.222 -0.445 . . . . 0.63 110.702 176.23 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 51.1 m -142.82 147.45 35.47 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.458 -0.571 . . . . 1.27 109.458 173.307 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -115.19 137.15 52.34 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.279 0.561 . . . . 0.64 111.248 -177.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -111.62 108.84 18.46 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 107.955 -1.128 . . . . 2.23 107.955 175.229 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 6.3 p -100.1 128.57 46.16 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.414 0.524 . . . . 1.38 112.414 -169.076 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.528 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 44.5 m80 -141.58 159.79 41.49 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-O 121.543 0.687 . . . . 1.98 111.52 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.489 HG23 ' HD2' ' A' ' 64' ' ' PHE . 0.6 OUTLIER -103.28 149.6 37.12 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 114.932 -1.031 . . . . 0.76 110.67 177.362 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 97' ' ' PRO . . . . . 0.528 ' HA ' ' HB3' ' A' ' 100' ' ' TYR . 22.2 Cg_endo -61.79 -24.81 77.85 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.838 2.359 . . . . 0.72 112.876 -178.536 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.429 HD22 ' HA ' ' A' ' 98' ' ' LEU . 0.3 OUTLIER -61.87 -51.41 68.33 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.803 -0.443 . . . . 2.08 109.803 179.047 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 19.7 mp0 -72.77 -33.36 66.26 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.084 -0.507 . . . . 2.69 111.118 177.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.528 ' HB3' ' HA ' ' A' ' 97' ' ' PRO . 50.0 t80 -58.65 -39.84 81.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.428 -0.351 . . . . 1.46 111.241 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -57.16 -36.1 70.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.997 0.427 . . . . 1.23 110.657 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.712 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.5 OUTLIER -70.44 -35.76 73.55 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.191 -0.459 . . . . 2.66 110.396 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 86.3 mt . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 1.31 111.12 -178.773 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.525 ' O ' HG23 ' A' ' 28' ' ' VAL . 53.3 t . . . . . 0 N--CA 1.456 -0.146 0 N-CA-C 110.523 -0.177 . . . . 1.71 110.523 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.9 tp -52.54 -31.99 16.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 O-C-N 123.642 0.589 . . . . 1.37 111.714 -177.459 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -60.64 -54.87 40.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.903 0.382 . . . . 1.75 110.101 176.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.1 tttp -71.98 -21.8 61.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.155 -0.475 . . . . 2.5 111.495 -178.311 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.525 HG23 ' O ' ' A' ' 24' ' ' CYS . 72.9 t -59.64 -45.26 94.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 109.644 -0.502 . . . . 1.04 109.644 174.666 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.12 -41.17 88.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.945 -0.571 . . . . 0.79 110.102 175.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 34' ' ' SER . 68.7 mt-10 -53.76 -52.22 60.88 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.22 -0.446 . . . . 2.2 111.037 178.31 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -75.43 -30.9 60.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.977 -0.556 . . . . 1.67 110.919 -174.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -60.68 -52.56 64.63 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.273 -0.421 . . . . 2.03 110.718 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -74.23 -26.03 60.01 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.847 -0.341 . . . . 0.57 110.699 178.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 30' ' ' GLU . 12.4 t -67.49 -39.19 85.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.321 -0.399 . . . . 1.29 110.413 179.315 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.0 m -71.33 -27.27 63.27 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.879 0.371 . . . . 0.78 110.973 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.43 -45.22 10.72 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.188 0.44 . . . . 0.64 112.188 -175.286 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 86.3 mt -95.63 -21.96 17.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.676 0.274 . . . . 0.94 111.391 -176.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt 56.11 80.42 0.29 Allowed Pre-proline 0 C--N 1.329 -0.317 0 C-N-CA 123.399 0.68 . . . . 3.36 112.116 -178.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -92.92 138.98 1.64 Allowed 'Trans proline' 0 N--CA 1.446 -1.294 0 C-N-CA 122.938 2.425 . . . . 0.63 111.684 171.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 13.5 p -75.7 -26.86 57.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.225 0.536 . . . . 0.73 109.808 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.485 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 88.2 t80 -140.87 137.35 33.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.338 -0.846 . . . . 0.76 109.757 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 48.4 tp -136.27 117.14 14.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.34 -0.391 . . . . 1.55 110.338 178.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.47 ' HB2' ' CE2' ' A' ' 41' ' ' PHE . 40.5 tt0 -112.63 115.23 28.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.161 -0.472 . . . . 2.23 110.502 -178.06 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -94.28 117.12 29.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 1.72 110.101 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 57.2 t -120.37 127.9 75.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.113 -0.494 . . . . 1.08 111.08 -178.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -75.77 101.36 5.04 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.374 0.607 . . . . 1.83 109.41 172.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.434 ' HE3' ' HB2' ' A' ' 47' ' ' LYS . 20.7 ttmt . . . . . 0 C--N 1.319 -0.729 0 CA-C-N 115.57 -0.741 . . . . 2.76 110.012 -175.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.427 ' HA ' ' O ' ' A' ' 89' ' ' ALA . 26.6 p . . . . . 0 N--CA 1.45 -0.432 0 CA-C-O 120.994 0.426 . . . . 1.71 111.891 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -111.57 135.97 51.42 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.913 -0.585 . . . . 1.15 109.533 174.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -119.27 118.38 31.1 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.449 -0.575 . . . . 1.35 109.449 179.205 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -109.79 122.77 48.25 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.053 0.454 . . . . 0.51 111.767 -174.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.401 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 61.3 t -91.57 111.64 24.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.746 -0.661 . . . . 0.55 109.265 174.132 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.472 ' CG1' ' HA ' ' A' ' 94' ' ' CYS . 1.4 pp -99.25 138.12 24.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.388 -0.369 . . . . 1.18 110.358 -176.394 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.485 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 66.0 t -124.76 99.76 6.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 108.999 -0.741 . . . . 0.58 108.999 174.437 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 31.4 t -139.25 148.19 42.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.053 0.454 . . . . 0.84 111.8 -174.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -67.66 -19.09 65.16 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.537 -0.756 . . . . 1.67 111.033 174.164 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -56.1 -40.0 73.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.817 0.342 . . . . 1.81 111.908 -175.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -94.25 5.24 52.38 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.942 0.349 . . . . 3.19 111.942 -171.555 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.44 -14.6 60.86 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.873 -0.517 . . . . 2.14 110.318 -178.348 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.546 ' OD2' ' HG2' ' A' ' 68' ' ' LYS . 23.1 t70 -81.27 -12.54 59.06 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.673 -0.694 . . . . 2.03 109.793 174.877 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt 67.79 35.96 3.72 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.195 -0.911 . . . . 3.31 110.731 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.892 ' HB3' ' HB2' ' A' ' 71' ' ' ASP . 32.2 mmtm -72.6 95.9 1.9 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.059 -0.519 . . . . 1.99 111.225 177.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.44 ' O ' ' HG3' ' A' ' 72' ' ' ARG . 2.8 tm? -73.71 -47.32 40.36 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.759 -0.46 . . . . 2.33 109.759 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.458 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.28 -32.09 72.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.275 -0.421 . . . . 1.09 111.253 -177.966 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.892 ' HB2' ' HB3' ' A' ' 68' ' ' LYS . 3.6 m-20 -73.94 -42.52 60.42 Favored 'General case' 0 CA--C 1.52 -0.209 0 C-N-CA 120.976 -0.29 . . . . 2.08 111.285 179.034 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.465 ' HE ' ' C ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -63.91 -28.32 69.75 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 120.128 -0.629 . . . . 2.93 109.589 178.168 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 54.7 t-80 -65.36 -58.88 4.79 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.19 -0.459 . . . . 1.21 110.064 176.639 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.526 ' HD3' ' OD1' ' A' ' 71' ' ' ASP . 5.6 ptm180 -63.91 -41.6 97.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.019 -0.537 . . . . 1.67 111.616 -175.099 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 89.2 mt -66.54 -51.39 57.08 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.631 0.253 . . . . 1.48 110.866 -177.612 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.863 HG13 HD22 ' A' ' 80' ' ' LEU . 25.3 t -58.49 -44.94 90.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.439 . . . . 0.82 111.171 -179.211 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.506 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 91.1 m-20 -63.61 -43.11 97.86 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.714 -0.394 . . . . 1.14 111.277 -177.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 35.0 m -67.85 -40.99 83.61 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.138 0.422 . . . . 0.69 112.138 -174.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.573 HG22 ' OE2' ' A' ' 83' ' ' GLU . 17.1 mt -90.07 -52.19 10.96 Favored 'Isoleucine or valine' 0 C--O 1.25 1.106 0 CA-C-O 122.011 0.91 . . . . 0.77 110.826 -175.13 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.863 HD22 HG13 ' A' ' 76' ' ' VAL . 9.7 mp -67.68 -9.85 47.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.352 -0.84 . . . . 0.78 110.477 -179.325 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.506 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 55.5 tptt -47.07 -56.84 5.81 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 109.592 -0.522 . . . . 1.93 109.592 165.374 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.581 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 43.7 mt-10 -74.99 -30.56 61.2 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.078 -0.51 . . . . 2.91 111.253 -179.06 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.595 ' HB2' ' HA ' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -52.56 -56.09 17.69 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 122.353 1.073 . . . . 1.66 110.91 173.764 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.779 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 32.9 mt -50.5 -30.69 13.43 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 112.94 -1.936 . . . . 0.58 112.906 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.581 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 26.1 mm-40 -59.12 -23.63 62.3 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 120.55 -0.46 . . . . 0.92 110.54 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 -102.28 -23.23 14.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.126 -0.488 . . . . 1.02 111.154 -178.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.9 mt -110.3 133.87 54.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.757 0.313 . . . . 0.77 111.03 -174.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 39.1 t60 -72.03 -43.34 65.13 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.853 0.359 . . . . 1.85 110.201 178.108 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.427 ' O ' ' HA ' ' A' ' 54' ' ' SER . . . -145.5 105.03 3.97 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.959 0.409 . . . . 0.78 110.862 178.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -105.37 132.83 51.06 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.0 0.429 . . . . 0.63 110.672 176.419 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.9 m -123.77 145.96 48.66 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.921 -0.581 . . . . 1.27 109.445 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -132.27 138.65 47.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.299 0.571 . . . . 0.64 111.499 -176.042 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -109.34 109.22 20.04 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.491 -0.777 . . . . 2.23 109.282 172.267 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.472 ' HA ' ' CG1' ' A' ' 59' ' ' ILE . 9.0 p -83.34 99.81 10.26 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.967 -0.561 . . . . 1.38 110.336 -176.642 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.5 m170 -118.45 163.01 17.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.452 0.644 . . . . 1.98 111.423 -178.032 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.97 156.32 50.26 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 115.275 -0.875 . . . . 0.76 110.732 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -58.63 -27.88 84.34 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.947 2.431 . . . . 0.72 112.823 -177.278 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.51 -51.21 70.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.977 0.418 . . . . 2.08 109.999 178.537 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.504 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 11.4 mp0 -65.6 -43.68 88.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.907 -0.588 . . . . 2.69 110.666 178.164 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -59.43 -37.39 77.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.095 -0.502 . . . . 1.46 110.938 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -57.9 -34.59 69.99 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.298 0.571 . . . . 1.23 110.503 178.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.639 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -78.89 -44.97 21.59 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.5 -0.773 . . . . 2.66 110.466 176.678 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 86.4 mt . . . . . 0 N--CA 1.464 0.259 0 CA-C-N 116.032 -0.531 . . . . 1.31 111.894 -176.058 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 67.8 m . . . . . 0 C--O 1.238 0.469 0 CA-C-O 121.15 0.5 . . . . 1.71 111.236 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 11.9 tt -67.15 -35.87 75.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.914 -0.584 . . . . 1.37 111.325 -177.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -62.12 -36.62 82.31 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 120.743 -0.383 . . . . 1.75 110.128 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.408 ' HD3' ' HB2' ' A' ' 31' ' ' ASP . 15.7 tppt? -65.63 -44.66 85.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.382 -0.372 . . . . 2.5 110.489 178.75 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.0 t -54.59 -54.31 23.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 CA-C-O 120.865 0.364 . . . . 1.04 110.93 178.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.438 HG13 ' OE1' ' A' ' 83' ' ' GLU . 1.8 mp -61.88 -54.64 31.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.029 -0.532 . . . . 0.79 110.992 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -55.41 -52.44 63.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.025 -0.534 . . . . 2.2 111.801 -174.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.408 ' HB2' ' HD3' ' A' ' 27' ' ' LYS . 0.7 OUTLIER -75.04 -28.54 60.46 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.675 -0.41 . . . . 1.67 111.381 -170.613 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.1 ttpm? -67.95 -48.13 66.74 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.615 -0.434 . . . . 2.03 110.665 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.405 HD12 ' N ' ' A' ' 34' ' ' SER . 4.4 pp -72.99 -29.64 63.2 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.781 -0.368 . . . . 0.57 110.944 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.405 ' N ' HD12 ' A' ' 33' ' ' LEU . 66.0 m -70.44 -34.8 72.88 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 116.574 -0.284 . . . . 1.29 111.058 178.632 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 56.4 m -71.59 -27.4 63.1 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.786 0.327 . . . . 0.78 111.2 177.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.7 -49.68 15.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.282 -0.417 . . . . 0.64 111.739 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 91.0 mt -84.15 -31.66 25.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.859 0.361 . . . . 0.94 110.401 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.471 ' HA ' ' HD2' ' A' ' 38' ' ' LYS . 41.5 tptt 55.57 88.46 0.12 Allowed Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 114.959 -1.019 . . . . 3.36 111.695 -176.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.897 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 97.4 Cg_endo -89.18 137.87 3.21 Favored 'Trans proline' 0 N--CA 1.451 -0.997 0 C-N-CA 122.743 2.295 . . . . 0.63 112.606 179.188 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.4 p -69.91 -29.85 67.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.452 0.644 . . . . 0.73 109.735 173.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.779 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 90.8 t80 -140.74 127.94 20.96 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.173 -0.921 . . . . 0.76 109.112 175.763 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.415 HD22 ' HA ' ' A' ' 42' ' ' LEU . 1.2 tm? -136.28 126.05 25.62 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.518 -0.549 . . . . 1.55 109.518 -178.613 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -129.64 127.84 41.41 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.735 -0.468 . . . . 2.23 109.735 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -94.99 115.75 27.83 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.78 -0.452 . . . . 1.72 109.78 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 60.8 t -103.44 121.76 55.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-N 116.041 -0.527 . . . . 1.08 110.395 -177.006 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -68.48 111.15 4.52 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.981 -0.554 . . . . 1.83 109.667 177.076 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.715 ' HD3' ' HB2' ' A' ' 56' ' ' ASP . 18.5 tptt . . . . . 0 N--CA 1.447 -0.578 0 N-CA-C 108.883 -0.784 . . . . 2.76 108.883 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.426 ' OG ' ' HB3' ' A' ' 47' ' ' LYS . 12.3 p . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 120.782 0.325 . . . . 1.71 110.963 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -127.4 133.53 49.99 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.323 -0.398 . . . . 1.15 110.818 -178.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.715 ' HB2' ' HD3' ' A' ' 47' ' ' LYS . 27.7 t0 -112.34 115.67 29.13 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.697 -0.853 . . . . 1.35 108.697 177.498 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.85 119.53 39.39 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.208 0.528 . . . . 0.51 111.738 -171.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 48.4 t -84.27 111.32 19.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.646 -0.706 . . . . 0.55 109.33 176.492 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.499 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -107.52 109.29 27.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.712 0.767 . . . . 1.18 110.45 -176.818 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.779 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 97.3 t -106.88 108.66 25.72 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 114.929 -1.032 . . . . 0.58 109.024 175.531 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.897 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 31.2 t -153.38 155.08 35.74 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.064 0.459 . . . . 0.84 111.935 -172.441 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.551 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 89.8 m-20 -62.55 -19.44 63.67 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.409 -0.814 . . . . 1.67 110.476 173.038 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -49.73 -46.62 50.52 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.775 -0.648 . . . . 1.81 111.307 176.518 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -94.17 2.5 55.94 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.898 -0.592 . . . . 3.19 110.812 -175.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.551 ' HB3' ' HA ' ' A' ' 62' ' ' ASN . 0.2 OUTLIER -85.25 -24.58 27.72 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-O 121.4 0.619 . . . . 2.14 109.527 -176.51 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -77.2 1.38 18.6 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.739 -0.664 . . . . 2.03 110.496 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 87.3 mttt 68.8 11.05 8.22 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.344 -0.844 . . . . 3.31 112.7 175.456 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.6 mmmm -84.51 89.43 7.43 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.155 -0.618 . . . . 1.99 110.229 -178.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.509 HD12 ' N ' ' A' ' 70' ' ' LEU . 3.3 pp -73.77 -34.25 64.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.033 -0.531 . . . . 2.33 111.082 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.509 ' N ' HD12 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -68.0 -33.88 75.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.336 -0.393 . . . . 1.09 111.036 178.387 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.676 ' O ' ' HG2' ' A' ' 74' ' ' ARG . 27.3 m-20 -74.03 -46.17 45.08 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.169 -0.213 . . . . 2.08 111.153 -178.63 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.48 ' HG2' ' HA ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -61.07 -34.51 75.01 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.21 -0.596 . . . . 2.93 109.918 176.84 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -64.44 -50.67 66.66 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.275 -0.421 . . . . 1.21 110.163 179.054 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.676 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 4.4 ptm180 -66.15 -36.25 82.62 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.218 -0.446 . . . . 1.67 110.944 -177.728 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 92.4 mt -66.94 -53.32 32.97 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.712 0.292 . . . . 1.48 110.659 178.516 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.633 HG13 HD22 ' A' ' 80' ' ' LEU . 54.9 t -58.18 -44.18 87.19 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 CA-C-N 116.029 -0.532 . . . . 0.82 110.895 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.555 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 4.4 m-20 -62.3 -42.03 99.01 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.637 0.236 . . . . 1.14 111.637 -178.655 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 47.2 m -69.15 -48.91 61.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.923 0.392 . . . . 0.69 111.577 -175.217 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 39.6 mt -75.49 -50.76 22.85 Favored 'Isoleucine or valine' 0 C--O 1.239 0.549 0 CA-C-O 121.522 0.677 . . . . 0.77 110.663 -177.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.9 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 9.6 mp -76.61 -5.36 47.42 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-N 115.631 -0.713 . . . . 0.78 111.377 -175.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.555 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 18.7 tppt? -52.39 -63.63 1.08 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.559 -0.534 . . . . 1.93 109.559 172.296 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -75.36 -30.71 60.29 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.758 -0.655 . . . . 2.91 110.963 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.9 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 5.0 tp10 -55.96 -54.36 45.68 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.003 0.43 . . . . 1.66 111.539 178.81 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.775 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 68.7 mt -50.69 -30.42 13.69 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-N 115.388 -0.824 . . . . 0.58 112.494 -178.608 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 -54.54 -28.29 44.51 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.629 0.252 . . . . 0.92 111.362 -176.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -92.35 0.81 57.47 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.031 0.443 . . . . 1.02 110.951 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.522 HG21 ' HB2' ' A' ' 90' ' ' PHE . 9.5 mt -121.73 143.21 35.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.121 -0.491 . . . . 0.77 109.847 -177.419 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 37.3 t60 -77.85 -46.06 22.51 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.699 -0.482 . . . . 1.85 109.699 176.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -153.77 102.74 2.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.07 -0.514 . . . . 0.78 110.982 178.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' PHE . . . . . 0.522 ' HB2' HG21 ' A' ' 87' ' ' ILE . 83.2 t80 -102.33 131.84 48.69 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.278 -0.419 . . . . 0.63 110.24 175.523 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 31.6 t -122.37 157.53 31.62 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.502 -0.555 . . . . 1.27 109.502 178.06 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -144.43 139.96 28.69 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.078 0.466 . . . . 0.64 110.958 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 26.5 mmtp -121.22 109.13 14.59 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.66 -0.7 . . . . 2.23 109.143 177.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.49 ' HA ' HG23 ' A' ' 59' ' ' ILE . 7.4 p -98.79 131.04 45.22 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.167 0.508 . . . . 1.38 112.23 -172.756 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.419 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 1.5 m170 -148.75 175.52 11.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.599 -0.728 . . . . 1.98 110.223 174.331 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.405 ' HB ' ' HD2' ' A' ' 97' ' ' PRO . 74.9 p -103.25 159.24 29.9 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.293 -0.412 . . . . 0.76 111.229 -175.948 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' PRO . . . . . 0.405 ' HD2' ' HB ' ' A' ' 96' ' ' THR . 20.4 Cg_endo -61.81 -26.41 79.44 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.634 2.222 . . . . 0.72 111.667 176.495 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.65 -48.94 75.19 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.417 -0.586 . . . . 2.08 109.417 178.34 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.554 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 11.4 mm-40 -61.24 -49.61 76.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.671 -0.695 . . . . 2.69 110.597 177.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -59.57 -42.88 93.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.856 -0.611 . . . . 1.46 110.882 -178.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -61.48 -37.69 84.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 1.23 110.842 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.801 ' HA ' ' HE3' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -65.18 -38.35 90.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.412 -0.358 . . . . 2.66 110.998 177.247 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 54.3 mt . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 116.041 -0.527 . . . . 1.31 110.67 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.468 ' O ' HG23 ' A' ' 28' ' ' VAL . 41.1 t . . . . . 0 N--CA 1.452 -0.328 0 N-CA-C 110.032 -0.359 . . . . 1.71 110.032 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 10.3 tp -54.08 -31.15 21.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.045 -0.525 . . . . 1.37 111.244 -178.553 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -59.38 -52.35 65.99 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.033 -0.53 . . . . 1.75 110.449 177.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -71.92 -29.64 64.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.818 -0.628 . . . . 2.5 111.116 -177.828 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 24' ' ' CYS . 87.1 t -56.94 -50.21 76.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.838 0.351 . . . . 1.04 110.392 177.397 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.699 HG23 ' HG3' ' A' ' 83' ' ' GLU . 1.7 mp -66.68 -39.85 84.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.972 -0.558 . . . . 0.79 110.546 177.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -59.14 -52.19 66.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.95 -0.568 . . . . 2.2 110.89 -177.316 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -67.24 -36.55 81.88 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.108 0.48 . . . . 1.67 110.494 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 53.4 tttm -64.46 -52.57 57.32 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.592 -0.731 . . . . 2.03 111.592 -176.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.435 HD12 ' N ' ' A' ' 34' ' ' SER . 4.6 pp -71.51 -28.45 63.91 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.753 -0.379 . . . . 0.57 110.549 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.435 ' N ' HD12 ' A' ' 33' ' ' LEU . 39.4 t -63.74 -45.2 90.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.094 0.473 . . . . 1.29 110.024 177.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.0 m -62.16 -27.41 68.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.789 -0.641 . . . . 0.78 111.926 -178.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -93.35 -54.67 3.59 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.031 0.382 . . . . 0.64 112.031 -177.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 96.5 mt -72.47 -30.83 64.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.373 -0.376 . . . . 0.94 111.335 -175.15 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm 61.12 68.07 1.31 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.871 -0.604 . . . . 3.36 111.45 -178.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.445 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 72.6 Cg_endo -90.32 126.92 1.36 Allowed 'Trans proline' 0 N--CA 1.447 -1.245 0 C-N-CA 122.549 2.166 . . . . 0.63 111.824 173.575 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.9 p -64.53 -26.36 68.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.301 0.572 . . . . 0.73 110.191 177.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.541 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 77.9 t80 -141.78 140.22 32.98 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.373 -0.83 . . . . 0.76 109.319 173.687 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -142.15 108.76 5.35 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.898 -0.778 . . . . 1.55 108.898 179.025 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.554 ' HB3' ' HB ' ' A' ' 58' ' ' VAL . 27.1 tt0 -100.14 140.36 34.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.402 -0.363 . . . . 2.23 110.104 -178.637 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -107.45 120.39 42.05 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.09 0.472 . . . . 1.72 110.862 -179.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 40.8 t -109.85 125.56 67.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 108.864 -0.791 . . . . 1.08 108.864 172.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -69.92 113.52 7.22 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.002 0.429 . . . . 1.83 109.908 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.432 ' O ' ' HB2' ' A' ' 54' ' ' SER . 0.7 OUTLIER . . . . . 0 C--N 1.32 -0.677 0 CA-C-N 116.109 -0.496 . . . . 2.76 110.394 -176.368 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.432 ' HB2' ' O ' ' A' ' 47' ' ' LYS . 14.6 m . . . . . 0 N--CA 1.447 -0.592 0 N-CA-C 109.808 -0.441 . . . . 1.71 109.808 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -135.14 141.37 45.95 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.654 -0.248 . . . . 1.15 110.502 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.68 108.44 17.49 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.455 -0.943 . . . . 1.35 108.455 174.492 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.78 118.54 36.84 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.996 0.427 . . . . 0.51 111.525 -173.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.554 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 32.2 t -83.59 112.5 21.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.538 -0.541 . . . . 0.55 109.538 177.582 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.507 HG12 ' HA ' ' A' ' 94' ' ' CYS . 2.8 pt -96.87 145.29 9.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.178 0.513 . . . . 1.18 110.675 -177.156 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.541 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 60.8 t -137.86 97.56 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 N-CA-C 108.028 -1.101 . . . . 0.58 108.028 174.842 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.445 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 40.8 t -144.61 150.66 37.81 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.04 0.756 . . . . 0.84 113.04 -170.825 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.689 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 7.7 m-20 -67.22 -19.19 65.5 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 114.818 -1.083 . . . . 1.67 110.886 172.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -55.55 -32.93 63.38 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.291 0.478 . . . . 1.81 112.291 -172.751 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -104.35 -3.07 24.62 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.191 0.441 . . . . 3.19 112.191 -173.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.689 ' HG2' ' O ' ' A' ' 62' ' ' ASN . 9.6 pt-20 -76.73 0.4 20.61 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.906 -0.496 . . . . 2.14 111.15 -177.511 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.445 ' OD2' ' HG3' ' A' ' 68' ' ' LYS . 26.6 t70 -88.98 -8.71 53.59 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.064 0.459 . . . . 2.03 110.061 177.146 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt 77.32 -13.82 0.91 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 115.244 -0.889 . . . . 3.31 112.887 174.504 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.445 ' HG3' ' OD2' ' A' ' 66' ' ' ASP . 29.9 mtmm -72.28 111.85 7.85 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.961 0.41 . . . . 1.99 110.971 176.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.4 pp -73.87 -31.41 63.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.796 -0.638 . . . . 2.33 111.738 -176.23 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.429 HD22 ' C ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -65.9 -31.1 71.85 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.677 -0.409 . . . . 1.09 111.335 -175.002 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.545 ' O ' ' HG2' ' A' ' 74' ' ' ARG . 1.5 t70 -73.88 -37.13 64.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.248 0.547 . . . . 2.08 109.969 -178.305 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.3 tmm_? -63.66 -44.14 94.66 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.967 -0.753 . . . . 2.93 108.967 174.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 21.1 t60 -61.48 -50.25 73.51 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.243 -0.889 . . . . 1.21 111.272 -178.495 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.545 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 9.3 ptm180 -62.0 -38.6 89.26 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.5 -0.318 . . . . 1.67 111.192 -177.244 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -67.4 -54.18 22.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.973 0.416 . . . . 1.48 110.633 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.86 HG13 HD22 ' A' ' 80' ' ' LEU . 65.2 t -58.86 -48.67 85.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.062 -0.517 . . . . 0.82 111.237 -177.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.497 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 5.8 m-20 -59.37 -48.23 82.42 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 121.161 -0.216 . . . . 1.14 111.464 -177.176 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 58.7 m -62.45 -54.77 35.23 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.813 0.671 . . . . 0.69 112.813 -173.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.639 HG22 ' OE2' ' A' ' 83' ' ' GLU . 5.1 mp -85.08 -48.38 16.44 Favored 'Isoleucine or valine' 0 C--O 1.247 0.947 0 CA-C-O 121.545 0.688 . . . . 0.77 111.103 -174.609 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.86 HD22 HG13 ' A' ' 76' ' ' VAL . 8.1 mp -68.51 -10.32 54.85 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.972 -0.558 . . . . 0.78 110.752 -177.151 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.497 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 20.7 tptm -52.01 -58.44 6.52 Favored 'General case' 0 C--N 1.333 -0.112 0 N-CA-C 109.493 -0.558 . . . . 1.93 109.493 165.439 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.572 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 39.5 mt-10 -60.8 -36.43 79.02 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.331 -0.85 . . . . 2.91 110.72 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.699 ' HG3' HG23 ' A' ' 29' ' ' ILE . 0.0 OUTLIER -52.76 -55.6 21.69 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 122.178 0.99 . . . . 1.66 110.381 173.254 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.757 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 54.6 mt -50.25 -30.6 12.09 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 113.061 -1.881 . . . . 0.58 112.691 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.572 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 20.7 mm-40 -61.64 -25.6 67.47 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 120.909 0.385 . . . . 0.92 110.736 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -98.35 -29.85 12.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.003 -0.544 . . . . 1.02 111.133 -176.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.488 HD12 ' HB2' ' A' ' 90' ' ' PHE . 2.7 mt -94.95 170.86 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 109.649 -0.5 . . . . 0.77 109.649 -178.546 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -94.63 -59.34 1.95 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.199 -0.667 . . . . 1.85 109.199 169.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -133.71 111.27 10.43 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.765 -0.652 . . . . 0.78 110.312 178.613 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' PHE . . . . . 0.488 ' HB2' HD12 ' A' ' 87' ' ' ILE . 90.2 t80 -95.21 122.51 37.97 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.112 0.482 . . . . 0.63 110.278 177.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 41.6 t -111.07 151.71 27.75 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.721 -0.672 . . . . 1.27 109.381 178.041 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -140.27 145.29 37.11 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.913 0.387 . . . . 0.64 110.849 -177.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.5 ' HG3' HG22 ' A' ' 58' ' ' VAL . 61.9 mmtt -105.89 113.87 27.68 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.325 -0.991 . . . . 2.23 108.325 173.223 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.507 ' HA ' HG12 ' A' ' 59' ' ' ILE . 5.5 p -83.39 110.35 18.08 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.093 0.473 . . . . 1.38 111.087 -176.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -135.86 160.29 39.04 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.433 0.635 . . . . 1.98 111.254 178.468 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.4 p -120.23 156.45 54.99 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.398 -0.819 . . . . 0.76 110.724 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -56.52 -52.12 7.71 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 123.259 2.639 . . . . 0.72 114.393 -170.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -61.19 -47.37 86.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.79 0.328 . . . . 2.08 111.398 -173.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 53.6 mp0 -68.14 -42.67 79.76 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.163 -0.471 . . . . 2.69 111.105 -178.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -63.95 -33.42 75.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 1.46 111.498 -176.405 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -62.8 -33.14 74.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.96 0.41 . . . . 1.23 111.147 -178.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.668 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -75.17 -20.63 59.24 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.438 -0.346 . . . . 2.66 110.684 179.478 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 83.5 mt . . . . . 0 C--N 1.326 -0.443 0 N-CA-C 109.84 -0.43 . . . . 1.31 109.84 175.819 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.447 ' O ' HG23 ' A' ' 28' ' ' VAL . 43.0 t . . . . . 0 N--CA 1.451 -0.414 0 N-CA-C 108.916 -0.772 . . . . 1.71 108.916 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.408 ' O ' HD13 ' A' ' 29' ' ' ILE . 7.2 tp -55.85 -43.93 76.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 120.624 0.249 . . . . 1.37 110.872 178.618 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -66.06 -35.68 81.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.97 0.414 . . . . 1.75 110.412 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -61.8 -39.32 91.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.819 -0.628 . . . . 2.5 110.432 179.186 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 24' ' ' CYS . 65.3 t -60.82 -49.5 84.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.91 -0.586 . . . . 1.04 110.254 178.164 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.442 HG13 ' CD ' ' A' ' 83' ' ' GLU . 1.7 mp -57.4 -49.75 79.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 116.089 -0.505 . . . . 0.79 110.62 178.773 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 81.9 mt-10 -58.77 -51.97 67.69 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.231 -0.441 . . . . 2.2 112.099 -176.601 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -70.16 -34.1 72.58 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.804 0.335 . . . . 1.67 110.815 -174.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.404 ' HD2' ' OE2' ' A' ' 83' ' ' GLU . 37.6 ttmt -61.82 -48.86 78.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.269 -0.423 . . . . 2.03 110.934 -178.799 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.6 pp -73.51 -26.22 60.79 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.887 -0.325 . . . . 0.57 110.629 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.432 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 67.0 m -72.37 -34.56 68.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.508 -0.314 . . . . 1.29 110.628 178.175 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.2 m -67.16 -27.43 67.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.15 0.5 . . . . 0.78 111.021 176.326 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.34 -54.82 3.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.095 -0.502 . . . . 0.64 111.843 -176.587 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.427 HD11 HG22 ' A' ' 76' ' ' VAL . 80.1 mt -84.06 -29.71 26.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.469 -0.332 . . . . 0.94 111.023 -175.637 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.3 tptm 55.84 78.38 0.38 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 115.454 -0.794 . . . . 3.36 111.216 -176.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.495 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 83.6 Cg_endo -87.97 173.56 4.95 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 122.67 2.247 . . . . 0.63 112.45 178.349 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.9 p -106.66 -27.61 10.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.141 0.496 . . . . 0.73 110.287 175.099 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.51 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 86.2 t80 -136.63 138.57 41.3 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.825 -0.625 . . . . 0.76 109.886 177.067 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 41.5 tp -142.21 116.45 9.5 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.255 -0.43 . . . . 1.55 110.418 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -125.58 109.53 12.76 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.4 -0.364 . . . . 2.23 110.674 178.592 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.671 ' HG ' ' HB2' ' A' ' 57' ' ' ALA . 9.1 mp -94.87 123.58 38.42 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.394 -0.595 . . . . 1.72 109.394 173.056 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 86.1 t -103.33 133.2 47.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 115.974 -0.557 . . . . 1.08 110.489 -176.393 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -64.11 110.08 2.05 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.711 -0.677 . . . . 1.83 109.595 174.491 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.915 ' HD2' ' HB2' ' A' ' 56' ' ' ASP . 79.3 tttt . . . . . 0 C--N 1.322 -0.611 0 CA-C-N 115.105 -0.952 . . . . 2.76 109.706 -173.662 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.504 ' HB3' ' HB3' ' A' ' 89' ' ' ALA . 1.7 p . . . . . 0 N--CA 1.454 -0.237 0 CA-C-O 120.478 0.18 . . . . 1.71 110.696 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -134.53 144.38 47.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.939 0.399 . . . . 1.15 111.372 -177.435 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.915 ' HB2' ' HD2' ' A' ' 47' ' ' LYS . 5.5 t70 -115.88 114.15 24.3 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.386 -0.968 . . . . 1.35 108.386 174.777 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.671 ' HB2' ' HG ' ' A' ' 44' ' ' LEU . . . -110.63 126.54 54.59 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.436 0.532 . . . . 0.51 112.436 -171.734 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.4 t -93.08 119.84 41.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.601 -0.727 . . . . 0.55 109.67 175.162 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.465 HD11 ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER -109.87 122.24 64.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 121.244 0.545 . . . . 1.18 110.471 -178.56 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.51 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 89.8 t -114.45 107.82 23.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.596 -0.729 . . . . 0.58 109.92 178.209 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.495 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 30.5 t -151.02 154.93 37.98 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.948 0.404 . . . . 0.84 111.693 -174.338 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.41 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 3.7 m-20 -67.25 -18.86 65.4 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.744 -0.662 . . . . 1.67 110.569 173.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -53.31 -24.19 11.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.258 -0.428 . . . . 1.81 111.892 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -103.23 -8.31 20.49 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 111.994 0.368 . . . . 3.19 111.994 -177.346 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.413 ' HB3' HG21 ' A' ' 96' ' ' THR . 0.0 OUTLIER -72.91 -14.31 61.44 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.96 -0.463 . . . . 2.14 110.988 -174.693 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -78.36 0.57 25.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.104 -0.498 . . . . 2.03 110.545 -176.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 84.9 tttt 71.73 2.09 4.15 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.705 -0.679 . . . . 3.31 111.174 176.684 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -80.28 89.62 5.51 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.046 0.45 . . . . 1.99 110.272 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.8 tt -70.91 -49.03 50.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.857 -0.611 . . . . 2.33 109.732 -179.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.515 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -60.85 -33.25 72.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.85 -0.613 . . . . 1.09 111.628 -179.557 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.515 ' N ' HD22 ' A' ' 70' ' ' LEU . 35.8 t70 -74.07 -48.06 32.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.931 0.396 . . . . 2.08 110.293 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.15 -36.28 74.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.243 0.544 . . . . 2.93 109.636 176.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 48.8 t60 -64.21 -54.8 27.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.505 -0.77 . . . . 1.21 110.774 178.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.438 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 15.5 ptm180 -64.98 -40.39 94.91 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.004 0.372 . . . . 1.67 112.004 -175.433 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 60.2 mt -60.22 -53.34 58.91 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.922 0.392 . . . . 1.48 110.787 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.427 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 78.6 t -61.17 -43.59 96.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.922 -0.581 . . . . 0.82 110.626 179.589 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.502 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 5.5 m-20 -64.17 -35.88 82.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.279 -0.418 . . . . 1.14 112.078 -177.365 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 88.6 m -71.92 -44.39 63.72 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.775 0.322 . . . . 0.69 111.335 -176.186 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.1 mt -76.84 -50.86 20.21 Favored 'Isoleucine or valine' 0 C--O 1.244 0.811 0 CA-C-O 121.769 0.795 . . . . 0.77 110.612 -178.545 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.775 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 10.5 mp -74.14 -9.29 58.47 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.356 -0.838 . . . . 0.78 111.418 -176.38 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 16.2 tttm -53.88 -61.93 1.98 Allowed 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 109.778 -0.453 . . . . 1.93 109.778 172.071 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.409 ' OE2' ' HA ' ' A' ' 82' ' ' GLU . 0.4 OUTLIER -72.18 -30.07 64.61 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.689 -0.687 . . . . 2.91 110.288 -178.074 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.681 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.5 tp10 -55.88 -47.52 77.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.334 -0.848 . . . . 1.66 111.588 175.381 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.775 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 54.4 mt -49.96 -30.87 11.23 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 114.8 -1.091 . . . . 0.58 113.58 -178.259 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -55.54 -18.06 6.63 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.562 0.578 . . . . 0.92 112.562 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -87.08 -8.19 57.31 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.749 0.309 . . . . 1.02 111.228 179.188 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.488 HD12 ' HB2' ' A' ' 90' ' ' PHE . 0.4 OUTLIER -133.27 175.87 10.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.885 -0.413 . . . . 0.77 109.885 -177.588 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 14.4 p80 -116.28 -13.99 11.07 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.622 -0.431 . . . . 1.85 110.969 173.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.504 ' HB3' ' HB3' ' A' ' 54' ' ' SER . . . -162.15 105.94 1.18 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.919 0.39 . . . . 0.78 111.418 -178.447 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' PHE . . . . . 0.488 ' HB2' HD12 ' A' ' 87' ' ' ILE . 91.2 t80 -132.17 122.04 24.66 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.919 -0.582 . . . . 0.63 110.046 175.477 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.4 p -116.54 144.8 43.9 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.712 0.291 . . . . 1.27 110.721 179.375 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -123.38 145.95 48.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.945 0.402 . . . . 0.64 111.102 -178.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 26.4 mmtp -125.66 120.23 30.17 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.877 -0.786 . . . . 2.23 108.877 177.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.407 ' HA ' HG23 ' A' ' 59' ' ' ILE . 5.9 p -101.25 135.47 42.67 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.487 0.551 . . . . 1.38 112.487 -172.32 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 8.5 m80 -147.74 172.61 13.82 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.536 -0.756 . . . . 1.98 109.473 174.005 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.413 HG21 ' HB3' ' A' ' 65' ' ' GLU . 0.3 OUTLIER -111.04 158.67 35.19 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-O 121.014 0.435 . . . . 0.76 111.843 -177.925 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 97' ' ' PRO . . . . . 0.487 ' HA ' ' HB3' ' A' ' 100' ' ' TYR . 26.1 Cg_exo -62.25 -18.36 61.99 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.201 2.601 . . . . 0.72 112.353 -177.549 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -59.63 -51.23 70.69 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.895 -0.593 . . . . 2.08 109.989 174.791 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -60.97 -44.81 96.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.109 0.481 . . . . 2.69 110.153 175.106 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.487 ' HB3' ' HA ' ' A' ' 97' ' ' PRO . 74.1 t80 -57.6 -41.24 80.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.367 -0.833 . . . . 1.46 111.486 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -58.87 -39.47 81.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.421 -0.354 . . . . 1.23 111.646 -178.035 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.694 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.8 OUTLIER -65.4 -37.68 87.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.817 0.341 . . . . 2.66 110.222 179.363 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 69.8 mt . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 115.703 -0.68 . . . . 1.31 111.114 -179.025 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 51.8 t . . . . . 0 N--CA 1.452 -0.355 0 N-CA-C 109.512 -0.551 . . . . 1.71 109.512 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.517 HD11 ' HB3' ' A' ' 86' ' ' ASN . 9.6 tp -61.41 -32.88 54.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.832 0.349 . . . . 1.37 110.899 -179.097 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -63.67 -38.9 92.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.266 -0.425 . . . . 1.75 110.186 178.005 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -67.16 -34.11 76.86 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.981 -0.554 . . . . 2.5 110.694 177.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 71.3 t -59.0 -55.35 24.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.716 0.293 . . . . 1.04 110.619 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.478 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 2.0 mp -63.91 -44.63 98.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.982 -0.554 . . . . 0.79 110.455 178.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.456 ' O ' ' HB2' ' A' ' 34' ' ' SER . 21.0 tt0 -52.4 -51.12 60.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.849 -0.614 . . . . 2.2 110.904 179.332 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -71.81 -38.07 70.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.446 -0.797 . . . . 1.67 111.344 -173.648 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -60.19 -55.96 27.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.322 -0.399 . . . . 2.03 111.583 -176.556 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 3.7 pp -74.1 -25.32 59.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.671 -0.241 . . . . 0.57 111.508 -178.799 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.456 ' HB2' ' O ' ' A' ' 30' ' ' GLU . 8.0 t -68.65 -36.76 79.0 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 121.044 -0.262 . . . . 1.29 110.652 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.1 m -70.43 -27.49 64.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.762 0.315 . . . . 0.78 110.946 178.274 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.429 ' CB ' HG12 ' A' ' 79' ' ' ILE . . . -85.25 -54.88 4.33 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.067 0.395 . . . . 0.64 112.067 -176.061 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.5 mt -85.09 -34.84 22.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.647 0.26 . . . . 0.94 110.839 -176.608 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.5 ttmt 58.92 84.78 0.2 Allowed Pre-proline 0 C--O 1.234 0.26 0 CA-C-N 115.391 -0.822 . . . . 3.36 111.727 178.4 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.755 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 93.8 Cg_endo -93.77 161.27 2.28 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 123.073 2.516 . . . . 0.63 112.72 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 32.7 p -89.4 -21.1 23.22 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.695 0.76 . . . . 0.73 109.177 173.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.625 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 89.9 t80 -141.39 132.07 25.63 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.053 -0.976 . . . . 0.76 109.47 175.079 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.5 tp -140.67 127.69 20.74 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.268 -0.423 . . . . 1.55 110.249 -179.049 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -139.14 124.11 18.82 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.959 0.409 . . . . 2.23 110.609 177.541 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.8 mp -95.84 117.27 30.25 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.934 -0.575 . . . . 1.72 109.509 175.418 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 31.6 t -103.12 130.64 52.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.684 -0.689 . . . . 1.08 110.262 -176.02 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -79.34 101.42 8.08 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.819 -0.437 . . . . 1.83 109.819 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.412 ' HG3' ' HB2' ' A' ' 56' ' ' ASP . 11.4 mmmm . . . . . 0 C--N 1.325 -0.471 0 CA-C-O 121.316 0.579 . . . . 2.76 110.354 -175.053 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 N--CA 1.455 -0.208 0 N-CA-C 109.834 -0.432 . . . . 1.71 109.834 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -121.64 161.56 22.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.995 0.426 . . . . 1.15 111.312 -174.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.425 ' HA ' ' O ' ' A' ' 91' ' ' SER . 12.7 t70 -118.15 127.23 53.57 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.252 -1.018 . . . . 1.35 108.252 171.842 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.91 115.8 30.85 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.138 0.494 . . . . 0.51 111.602 -174.122 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.3 t -81.76 111.15 17.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.652 -0.704 . . . . 0.55 109.194 174.436 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.479 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -106.56 114.34 45.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.188 0.518 . . . . 1.18 110.049 -178.494 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.625 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 97.1 t -110.02 103.86 16.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.814 -0.63 . . . . 0.58 109.976 178.054 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.755 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 46.2 t -154.55 149.38 26.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.152 0.501 . . . . 0.84 111.171 -177.179 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.563 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 14.1 m120 -67.3 -18.64 65.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.451 -0.795 . . . . 1.67 111.176 176.035 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -47.97 -24.45 1.06 Allowed 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 112.369 0.507 . . . . 1.81 112.369 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.51 ' HD1' ' HB2' ' A' ' 68' ' ' LYS . 76.9 m-85 -118.6 16.05 13.68 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 112.196 0.443 . . . . 3.19 112.196 -178.806 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.563 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 1.0 OUTLIER -68.82 -15.85 63.62 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 120.795 0.331 . . . . 2.14 111.734 -176.153 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.593 ' HB3' ' HD3' ' A' ' 68' ' ' LYS . 31.0 t70 -84.37 15.6 3.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.252 0.548 . . . . 2.03 110.118 179.557 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.415 ' NZ ' ' HB2' ' A' ' 67' ' ' LYS . 10.6 mtmp? 57.62 51.02 10.03 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.616 -0.72 . . . . 3.31 109.845 -175.845 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.914 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 31.2 mmmt -76.91 89.03 3.48 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.871 -0.604 . . . . 1.99 110.436 -176.149 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.7 tt -73.66 -55.01 6.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.294 0.568 . . . . 2.33 109.681 177.603 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.493 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.5 -31.43 71.56 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.418 -0.81 . . . . 1.09 110.796 -178.341 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.914 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 25.5 t70 -73.68 -35.71 65.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.901 0.382 . . . . 2.08 110.306 -178.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -39.4 93.55 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.317 -0.623 . . . . 2.93 109.317 174.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 39.6 t60 -65.51 -51.35 60.6 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.895 -0.593 . . . . 1.21 110.64 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.544 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 3.8 ptm180 -66.54 -48.19 70.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.311 -0.404 . . . . 1.67 111.81 -176.121 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -61.39 -45.03 96.06 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.57 0.224 . . . . 1.48 111.446 -177.038 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.755 HG13 HD22 ' A' ' 80' ' ' LEU . 41.9 t -59.99 -42.57 90.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.427 -0.351 . . . . 0.82 110.732 178.18 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -65.62 -43.6 89.06 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.947 -0.301 . . . . 1.14 111.181 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 45.1 m -61.82 -55.92 24.93 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.988 0.366 . . . . 0.69 111.988 -177.273 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.429 HG12 ' CB ' ' A' ' 36' ' ' ALA . 4.2 mp -78.5 -48.6 22.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 120.819 0.342 . . . . 0.77 111.416 -176.628 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.774 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.7 mp -73.48 -6.68 47.92 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 116.509 -0.314 . . . . 0.78 111.741 -173.616 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -49.75 -54.59 18.09 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.335 -0.617 . . . . 1.93 109.335 167.484 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.428 ' O ' ' HG2' ' A' ' 85' ' ' GLN . 36.6 tt0 -75.19 -40.27 59.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.467 -0.788 . . . . 2.91 110.713 178.334 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.774 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.8 tp10 -53.71 -51.34 63.58 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.456 -0.793 . . . . 1.66 112.025 -177.679 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.687 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 67.3 mt -50.31 -30.71 12.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.204 -0.907 . . . . 0.58 112.614 -177.089 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.428 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 17.6 mm-40 -52.24 -26.53 12.03 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 111.886 0.328 . . . . 0.92 111.886 -176.518 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.517 ' HB3' HD11 ' A' ' 25' ' ' ILE . 29.8 m-80 -100.23 1.49 41.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.872 0.367 . . . . 1.02 111.209 -177.231 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.456 HD11 ' HG3' ' A' ' 83' ' ' GLU . 0.5 OUTLIER -130.56 175.9 9.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 110.007 -0.368 . . . . 0.77 110.007 -175.552 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 56.1 m-70 -123.16 -73.85 0.63 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.314 0.578 . . . . 1.85 110.008 176.01 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -104.91 57.72 0.69 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.406 -0.816 . . . . 0.78 110.505 -175.423 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -75.19 145.27 42.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.984 -0.553 . . . . 0.63 110.887 -177.666 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.425 ' O ' ' HA ' ' A' ' 56' ' ' ASP . 40.1 t -140.32 167.62 21.72 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.927 -0.579 . . . . 1.27 109.513 178.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -148.58 149.88 32.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.713 0.292 . . . . 0.64 110.707 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -125.03 109.85 13.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.183 -0.462 . . . . 2.23 110.044 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.423 ' HA ' HG23 ' A' ' 59' ' ' ILE . 4.1 p -83.41 126.91 33.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.23 0.538 . . . . 1.38 111.713 -176.287 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.452 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 45.9 m80 -142.07 162.94 34.22 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.556 -0.747 . . . . 1.98 110.038 178.274 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.5 p -112.56 154.61 44.6 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 116.524 -0.307 . . . . 0.76 110.963 176.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -59.1 -26.69 82.62 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 123.031 2.487 . . . . 0.72 112.522 -178.8 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -61.2 -46.43 90.48 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.872 -0.604 . . . . 2.08 110.173 177.087 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -71.57 -41.07 69.49 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.802 -0.635 . . . . 2.69 110.706 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -56.73 -40.94 76.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.906 -0.588 . . . . 1.46 111.614 -178.424 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -58.1 -35.89 72.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.85 0.357 . . . . 1.23 111.043 -178.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.692 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -74.18 -32.58 63.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.802 0.334 . . . . 2.66 110.288 179.04 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 85.8 mt . . . . . 0 C--N 1.325 -0.467 0 CA-C-N 116.323 -0.399 . . . . 1.31 110.54 179.173 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.4 t . . . . . 0 C--O 1.235 0.293 0 N-CA-C 109.47 -0.567 . . . . 1.71 109.47 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.505 HD11 ' HB3' ' A' ' 86' ' ' ASN . 8.6 tp -56.87 -35.82 47.92 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-O 120.886 0.374 . . . . 1.37 110.291 176.409 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -58.4 -45.98 87.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.832 -0.622 . . . . 1.75 110.527 176.194 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.817 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -57.66 -42.85 84.33 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.85 -0.614 . . . . 2.5 110.627 -178.869 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.526 ' O ' ' HG2' ' A' ' 32' ' ' LYS . 60.4 t -58.82 -49.98 81.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-N 116.023 -0.535 . . . . 1.04 110.711 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.551 HD11 ' HB2' ' A' ' 86' ' ' ASN . 1.7 mp -58.8 -46.01 91.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.895 -0.593 . . . . 0.79 110.243 178.095 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 62.2 mt-10 -53.33 -50.42 65.03 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.106 -0.497 . . . . 2.2 111.037 177.804 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -60.03 -33.88 72.62 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.227 -0.442 . . . . 1.67 111.853 -176.544 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.526 ' HG2' ' O ' ' A' ' 28' ' ' VAL . 14.8 mmmm -71.27 -55.65 7.63 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.858 -0.337 . . . . 2.03 111.091 -178.105 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.496 HD12 ' N ' ' A' ' 34' ' ' SER . 4.1 pp -69.43 -28.55 66.23 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.9 0.333 . . . . 0.57 111.9 -176.755 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.496 ' N ' HD12 ' A' ' 33' ' ' LEU . 52.5 p -72.1 -33.29 67.74 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.876 -0.33 . . . . 1.29 110.884 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 52.3 m -68.14 -34.84 77.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.916 0.388 . . . . 0.78 110.755 178.016 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.28 -54.56 4.24 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.243 0.46 . . . . 0.64 112.243 -175.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.3 mt -81.6 -23.85 36.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.396 -0.365 . . . . 0.94 110.805 -175.792 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.401 ' HA ' ' O ' ' A' ' 34' ' ' SER . 64.3 mttp 49.28 69.19 2.84 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 115.579 -0.737 . . . . 3.36 112.193 -179.473 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.508 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 71.5 Cg_endo -80.85 134.53 9.62 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.039 1.826 . . . . 0.63 112.034 176.748 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 20.8 p -67.02 -30.72 70.88 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.091 0.472 . . . . 0.73 110.045 177.739 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.585 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 81.3 t80 -140.43 139.16 35.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.811 -0.632 . . . . 0.76 109.851 176.144 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 60.9 tp -135.1 121.69 20.69 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.339 -0.391 . . . . 1.55 110.131 178.518 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.404 ' HB3' ' HB ' ' A' ' 58' ' ' VAL . 43.3 tt0 -119.49 115.74 24.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.982 0.42 . . . . 2.23 110.517 179.33 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -91.26 115.64 28.19 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.06 -0.518 . . . . 1.72 109.735 178.49 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 40.4 t -114.41 142.44 27.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.498 0.666 . . . . 1.08 110.676 -178.219 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.56 123.92 23.53 Favored 'General case' 0 N--CA 1.438 -1.041 0 CA-C-N 114.957 -1.019 . . . . 1.83 108.836 178.583 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.404 ' HD3' ' HB2' ' A' ' 54' ' ' SER . 45.4 tttp . . . . . 0 C--N 1.325 -0.488 0 CA-C-N 115.929 -0.578 . . . . 2.76 111.335 -169.346 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.509 ' HB3' ' HB3' ' A' ' 89' ' ' ALA . 4.2 p . . . . . 0 N--CA 1.446 -0.653 0 CA-C-O 120.95 0.405 . . . . 1.71 110.571 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -113.12 132.53 55.41 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.115 -0.493 . . . . 1.15 110.03 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -114.82 109.5 18.26 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.342 -0.984 . . . . 1.35 108.342 175.236 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.99 120.06 40.79 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.256 0.55 . . . . 0.51 111.832 -170.253 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.404 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 59.0 t -79.26 114.21 19.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 115.35 -0.841 . . . . 0.55 109.016 173.541 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.487 ' CG1' ' HA ' ' A' ' 94' ' ' CYS . 1.2 pp -96.73 136.19 28.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.719 -0.475 . . . . 1.18 109.719 -177.498 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.585 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 90.0 t -130.81 97.9 3.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 108.772 -0.825 . . . . 0.58 108.772 176.778 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.508 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 40.8 t -145.39 150.92 37.43 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.291 0.567 . . . . 0.84 111.977 -173.151 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.691 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 90.5 m-20 -67.96 -19.15 64.93 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.354 -0.839 . . . . 1.67 110.178 172.029 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -62.57 -9.07 7.6 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.013 0.435 . . . . 1.81 111.325 -178.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -116.34 -11.83 11.18 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.125 0.417 . . . . 3.19 112.125 -177.247 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.691 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -74.01 -13.73 60.91 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.382 0.512 . . . . 2.14 112.382 -171.473 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.444 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . 7.7 t70 -91.55 10.95 25.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.006 0.431 . . . . 2.03 110.059 178.268 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.49 ' HE3' ' HB2' ' A' ' 67' ' ' LYS . 24.9 ttmt 65.97 39.05 4.66 Favored 'General case' 0 C--N 1.338 0.105 0 CA-C-N 115.627 -0.715 . . . . 3.31 109.392 176.473 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.642 ' HB3' ' HB2' ' A' ' 71' ' ' ASP . 64.4 mmtt -78.93 101.29 7.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.2 -0.909 . . . . 1.99 112.469 -173.846 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 28.9 tp -73.81 -59.74 2.58 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.026 -0.534 . . . . 2.33 110.146 171.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.431 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.82 -34.12 76.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.756 -0.657 . . . . 1.09 111.821 -170.895 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.642 ' HB2' ' HB3' ' A' ' 68' ' ' LYS . 27.1 m-20 -73.86 -43.55 58.27 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.699 0.259 . . . . 2.08 111.699 -176.343 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 34.9 ptt180 -64.6 -35.37 80.78 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.079 -0.648 . . . . 2.93 109.586 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -65.13 -52.99 51.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.874 -0.603 . . . . 1.21 110.498 179.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.505 ' CD ' ' HA ' ' A' ' 71' ' ' ASP . 5.8 ptm180 -64.6 -43.46 93.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.254 -0.43 . . . . 1.67 111.296 -175.392 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.421 HD12 ' HG3' ' A' ' 74' ' ' ARG . 8.4 mp -65.56 -48.47 72.3 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.552 0.215 . . . . 1.48 110.961 -178.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.765 HG13 HD22 ' A' ' 80' ' ' LEU . 38.2 t -59.86 -43.88 93.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.554 -0.294 . . . . 0.82 110.866 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -62.76 -46.83 86.22 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.868 -0.333 . . . . 1.14 111.04 -178.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 63.0 m -61.42 -55.94 25.77 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.17 0.433 . . . . 0.69 112.17 -177.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.0 mp -75.29 -50.25 24.94 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 120.968 0.413 . . . . 0.77 111.208 -175.364 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.972 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.5 mp -71.74 -5.5 34.47 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 116.371 -0.377 . . . . 0.78 111.279 -177.072 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -49.92 -63.97 0.95 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.065 0.46 . . . . 1.93 109.834 170.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.428 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 5.4 pt-20 -75.39 -31.43 60.45 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.156 -0.474 . . . . 2.91 110.929 177.309 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.972 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 34.0 tt0 -58.48 -43.96 89.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.543 -0.299 . . . . 1.66 111.127 -177.222 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.76 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 69.3 mt -57.54 -30.6 65.33 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.127 -0.488 . . . . 0.58 111.671 179.435 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.428 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 24.4 mm-40 -59.54 -17.93 36.39 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.848 0.356 . . . . 0.92 111.121 -177.202 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.551 ' HB2' HD11 ' A' ' 29' ' ' ILE . 23.4 m-80 -102.44 3.05 37.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.428 -0.351 . . . . 1.02 110.957 -177.007 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.497 HG21 ' HB2' ' A' ' 90' ' ' PHE . 8.9 mt -124.12 147.67 28.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.645 0.259 . . . . 0.77 110.564 -175.343 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 59.0 t60 -78.97 -45.18 20.88 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.811 -0.44 . . . . 1.85 109.811 175.153 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.509 ' HB3' ' HB3' ' A' ' 54' ' ' SER . . . -158.92 106.16 1.81 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 0.78 110.504 178.446 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' PHE . . . . . 0.497 ' HB2' HG21 ' A' ' 87' ' ' ILE . 76.2 t80 -103.35 138.02 40.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.259 -0.428 . . . . 0.63 110.357 177.934 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 50.7 m -140.26 145.14 36.94 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.668 -0.493 . . . . 1.27 109.668 175.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -123.35 151.79 42.16 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.168 0.508 . . . . 0.64 111.637 -175.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.0 mmtm -117.38 118.28 31.8 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.437 -0.801 . . . . 2.23 108.957 173.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.487 ' HA ' ' CG1' ' A' ' 59' ' ' ILE . 80.8 m -83.78 117.23 23.13 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.137 0.494 . . . . 1.38 111.605 -171.143 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 70.2 m80 -140.33 161.22 38.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.958 -0.565 . . . . 1.98 110.332 176.169 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.653 ' HB ' ' HD2' ' A' ' 97' ' ' PRO . 31.0 p -110.63 168.25 7.88 Favored Pre-proline 0 C--N 1.32 -0.676 0 N-CA-C 109.209 -0.664 . . . . 0.76 109.209 174.642 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' PRO . . . . . 0.653 ' HD2' ' HB ' ' A' ' 96' ' ' THR . 12.1 Cg_endo -58.29 -28.53 84.88 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.092 1.861 . . . . 0.72 111.456 174.128 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.404 ' H ' HD22 ' A' ' 98' ' ' LEU . 2.6 mm? -72.92 -51.44 18.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 2.08 109.883 178.822 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.578 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 1.5 mp0 -58.54 -50.99 71.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.008 -0.542 . . . . 2.69 111.133 179.357 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -65.21 -43.39 91.71 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.742 0.275 . . . . 1.46 111.742 -175.244 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -62.99 -33.31 75.14 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.988 0.423 . . . . 1.23 110.769 -177.53 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.606 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.3 OUTLIER -78.41 -15.53 58.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.486 -0.325 . . . . 2.66 111.173 179.024 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 93.6 mt . . . . . 0 N--CA 1.464 0.226 0 CA-C-O 121.087 0.47 . . . . 1.31 109.947 175.365 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.8 m . . . . . 0 N--CA 1.447 -0.585 0 N-CA-C 110.004 -0.369 . . . . 1.71 110.004 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.492 ' O ' HD13 ' A' ' 29' ' ' ILE . 0.0 OUTLIER -57.18 -35.51 48.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.233 -0.439 . . . . 1.37 110.049 179.672 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.526 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 6.9 tp-100 -57.35 -53.78 54.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.9 -0.591 . . . . 1.75 110.924 177.341 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.9 tptp -63.88 -40.78 97.32 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.894 -0.594 . . . . 2.5 111.04 -173.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 66.6 t -60.55 -46.94 94.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.208 -0.451 . . . . 1.04 111.041 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.538 ' HA ' ' OE2' ' A' ' 83' ' ' GLU . 1.5 mp -58.84 -47.08 90.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.932 -0.576 . . . . 0.79 110.398 179.036 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.526 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 74.8 mt-10 -56.03 -52.0 65.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 2.2 111.003 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -63.34 -36.82 84.96 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.833 0.679 . . . . 1.67 112.833 -172.001 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -72.57 -47.87 44.58 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.53 -0.468 . . . . 2.03 111.61 -177.044 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.481 HD12 ' N ' ' A' ' 34' ' ' SER . 4.6 pp -74.26 -31.41 62.55 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 120.581 -0.448 . . . . 0.57 111.722 -179.197 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.481 ' N ' HD12 ' A' ' 33' ' ' LEU . 66.4 m -68.69 -33.58 74.21 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 121.151 -0.22 . . . . 1.29 111.4 -178.195 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.5 m -67.85 -27.33 66.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.95 0.405 . . . . 0.78 110.812 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.95 -52.74 4.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 0.64 111.767 -177.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 73.2 mt -85.0 -33.06 22.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.532 -0.304 . . . . 0.94 111.738 -173.704 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm 55.48 75.2 0.62 Allowed Pre-proline 0 N--CA 1.466 0.364 0 CA-C-N 116.045 -0.525 . . . . 3.36 112.173 -178.031 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.526 ' HB3' HG12 ' A' ' 59' ' ' ILE . 72.4 Cg_endo -82.7 133.77 7.13 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.408 2.072 . . . . 0.63 111.989 175.498 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 37.7 p -73.09 -30.53 63.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.578 0.704 . . . . 0.73 109.753 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -141.88 132.55 25.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.111 -0.95 . . . . 0.76 109.328 176.544 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.43 HD12 ' HG3' ' A' ' 39' ' ' PRO . 1.1 tt -142.24 118.95 11.08 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.196 -0.668 . . . . 1.55 109.196 179.772 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -116.96 120.51 38.63 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.89 0.376 . . . . 2.23 110.348 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.493 ' HG ' ' OE1' ' A' ' 26' ' ' GLN . 4.3 mm? -87.86 121.24 30.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.853 -0.612 . . . . 1.72 110.212 178.154 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 40.9 t -109.35 122.11 63.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.215 -0.448 . . . . 1.08 110.339 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -67.92 102.52 1.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.4 -0.593 . . . . 1.83 109.4 176.312 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.519 ' HD2' ' HB2' ' A' ' 56' ' ' ASP . 51.8 tttm . . . . . 0 C--N 1.321 -0.643 0 N-CA-C 109.362 -0.606 . . . . 2.76 109.362 -178.47 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.9 m . . . . . 0 N--CA 1.455 -0.183 0 CA-C-O 120.834 0.35 . . . . 1.71 110.987 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -125.28 136.17 53.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.945 -0.57 . . . . 1.15 109.6 173.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.519 ' HB2' ' HD2' ' A' ' 47' ' ' LYS . 19.3 t70 -113.24 122.39 47.31 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.89 -0.411 . . . . 1.35 109.89 -177.809 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -118.77 122.27 42.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.773 0.321 . . . . 0.51 111.606 -175.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 58.3 t -86.86 111.23 21.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 109.552 -0.536 . . . . 0.55 109.552 176.179 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.526 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -110.01 116.31 51.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.485 0.659 . . . . 1.18 110.627 -176.521 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.653 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 41.8 t -108.09 114.06 45.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.356 -0.838 . . . . 0.58 109.382 176.812 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 87.5 p -145.66 146.38 31.28 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.245 -0.582 . . . . 0.84 112.256 -177.188 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -67.22 -22.8 65.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.462 -0.79 . . . . 1.67 110.755 172.251 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -62.59 -32.11 73.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.094 -0.503 . . . . 1.81 112.282 -172.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 31.6 m-85 -98.41 0.51 45.48 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.959 -0.297 . . . . 3.19 111.256 -178.576 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.08 -18.97 62.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.556 -0.293 . . . . 2.14 111.742 -173.644 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -84.46 -9.66 58.18 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.918 0.389 . . . . 2.03 110.862 -175.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt 69.12 19.57 7.94 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.884 0.698 . . . . 3.31 112.884 169.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.662 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 29.0 mmmt -75.07 110.76 9.65 Favored 'General case' 0 C--N 1.327 -0.41 0 O-C-N 121.771 -0.581 . . . . 1.99 109.627 178.666 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.498 ' HA ' ' NE ' ' A' ' 72' ' ' ARG . 3.4 pp -66.53 -48.11 70.76 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.319 0.489 . . . . 2.33 112.319 -167.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.426 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.82 -30.93 70.46 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.877 0.37 . . . . 1.09 110.767 -178.204 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.426 ' N ' HD22 ' A' ' 70' ' ' LEU . 20.4 t70 -73.32 -47.54 41.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.003 -0.544 . . . . 2.08 110.341 -175.627 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.662 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 10.9 ptt85 -66.68 -33.93 76.75 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.409 -0.36 . . . . 2.93 110.806 177.044 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -66.82 -50.29 63.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.48 -0.327 . . . . 1.21 110.739 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -65.67 -37.33 86.19 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.61 -0.268 . . . . 1.67 110.995 -176.168 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 66.9 mt -64.13 -57.85 8.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.843 0.354 . . . . 1.48 110.886 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.756 HG13 HD12 ' A' ' 80' ' ' LEU . 64.4 t -57.41 -49.99 78.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.053 -0.521 . . . . 0.82 111.541 -176.517 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.447 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 5.1 m-20 -65.69 -42.89 90.68 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.959 -0.296 . . . . 1.14 111.57 -174.447 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 85.2 m -63.24 -53.98 44.47 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.852 0.316 . . . . 0.69 111.852 -176.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.4 mp -76.95 -51.1 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.81 0.338 . . . . 0.77 111.196 -177.109 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.871 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 15.4 mt -72.06 -15.16 62.02 Favored 'General case' 0 C--O 1.214 -0.8 0 N-CA-C 113.068 0.766 . . . . 0.78 113.068 -171.205 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 31.3 tttm -65.82 -56.11 13.61 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 119.163 0.892 . . . . 1.93 109.892 175.556 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.427 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 15.0 tm-20 -58.37 -32.58 68.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.323 -0.853 . . . . 2.91 109.499 176.059 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.66 ' HG2' HD23 ' A' ' 80' ' ' LEU . 6.0 tp10 -60.48 -53.74 53.88 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 114.912 -1.04 . . . . 1.66 111.11 176.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.871 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 45.4 mt -50.33 -30.65 12.56 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 114.276 -1.329 . . . . 0.58 112.059 178.881 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.427 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 30.7 mm-40 -51.79 -24.83 6.52 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 111.721 0.267 . . . . 0.92 111.721 -177.805 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.53 ' HB2' HD11 ' A' ' 29' ' ' ILE . 32.5 m-80 -94.07 -6.77 44.36 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.839 0.352 . . . . 1.02 111.417 -178.632 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 2.7 mt -120.26 151.18 22.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 109.891 -0.411 . . . . 0.77 109.891 -174.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -75.48 -45.81 36.18 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.267 -0.573 . . . . 1.85 109.721 175.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.67 117.26 3.99 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.024 -0.534 . . . . 0.78 110.18 177.226 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -116.02 122.35 44.95 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.108 -0.496 . . . . 0.63 110.669 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.7 p -115.33 129.5 56.62 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.322 -0.399 . . . . 1.27 110.253 176.727 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -107.33 139.49 41.72 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.162 0.506 . . . . 0.64 110.591 -178.088 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -108.14 111.03 22.84 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.088 -0.708 . . . . 2.23 109.088 176.31 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 45.8 t -83.23 116.14 22.26 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.339 -0.391 . . . . 1.38 110.354 -174.201 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.653 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 59.2 t60 -130.12 138.98 50.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.478 0.656 . . . . 1.98 110.35 -178.79 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -98.2 146.36 31.4 Favored Pre-proline 0 C--N 1.318 -0.803 0 CA-C-N 115.561 -0.745 . . . . 0.76 111.383 -179.364 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' PRO . . . . . 0.459 ' HA ' ' HB3' ' A' ' 100' ' ' TYR . 37.1 Cg_endo -67.14 -21.84 48.05 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.962 2.441 . . . . 0.72 112.808 -178.229 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -64.14 -51.29 64.59 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.045 -0.724 . . . . 2.08 109.045 177.108 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -70.76 -29.58 65.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.997 -0.547 . . . . 2.69 110.653 178.644 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.459 ' HB3' ' HA ' ' A' ' 97' ' ' PRO . 85.3 t80 -62.27 -41.05 98.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.197 -0.456 . . . . 1.46 110.662 178.14 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -60.97 -33.66 73.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 1.23 110.943 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.704 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.5 OUTLIER -71.6 -24.95 61.98 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.32 -0.4 . . . . 2.66 110.952 -179.552 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 86.1 mt . . . . . 0 C--N 1.327 -0.371 0 CA-C-N 116.36 -0.382 . . . . 1.31 110.25 178.605 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 43.4 t . . . . . 0 C--O 1.234 0.262 0 CA-C-O 120.603 0.239 . . . . 1.71 110.725 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.4 tp -52.5 -39.45 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 115.669 -0.696 . . . . 1.37 111.75 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -64.83 -39.32 93.38 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.199 0.523 . . . . 1.75 110.914 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.416 ' HB2' ' HE3' ' A' ' 27' ' ' LYS . 39.3 ttmt -70.34 -40.02 74.36 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.513 -0.767 . . . . 2.5 110.658 -177.075 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.3 t -66.21 -46.38 87.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.899 -0.591 . . . . 1.04 111.082 -178.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.58 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.5 mp -59.49 -49.3 84.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.79 111.44 -178.626 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.418 ' HG3' HD21 ' A' ' 44' ' ' LEU . 1.3 tm-20 -61.17 -39.14 89.01 Favored 'General case' 0 C--O 1.226 -0.177 0 N-CA-C 110.244 -0.28 . . . . 2.2 110.244 -177.768 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -64.2 -44.24 92.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.528 -0.305 . . . . 1.67 111.079 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -70.53 -55.48 8.79 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 112.343 0.498 . . . . 2.03 112.343 -173.657 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 3.3 pp -68.69 -29.3 67.72 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.433 -0.507 . . . . 0.57 111.498 -175.628 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.535 ' N ' HD12 ' A' ' 33' ' ' LEU . 55.0 m -73.4 -35.67 65.91 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.794 -0.362 . . . . 1.29 111.349 177.895 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.9 m -67.0 -27.46 67.44 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.851 -0.34 . . . . 0.78 111.092 176.46 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -92.38 -54.9 3.61 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 112.431 0.53 . . . . 0.64 112.431 -176.163 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.7 mt -79.46 -26.6 41.68 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.832 0.349 . . . . 0.94 110.673 -177.315 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 65.1 mttm 59.3 72.92 0.74 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.278 -0.874 . . . . 3.36 112.671 176.188 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.449 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 84.6 Cg_endo -91.29 165.71 3.62 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 122.876 2.384 . . . . 0.63 111.635 172.496 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 28.6 p -94.22 -32.27 13.75 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.038 0.446 . . . . 0.73 110.258 178.233 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.708 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 82.8 t80 -133.05 134.37 44.28 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.776 -0.647 . . . . 0.76 109.867 178.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -142.29 113.31 7.53 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.563 -0.532 . . . . 1.55 109.563 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -111.56 134.69 52.96 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.953 -0.388 . . . . 2.23 109.953 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.418 HD21 ' HG3' ' A' ' 30' ' ' GLU . 3.5 mm? -110.92 124.9 53.02 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.782 0.325 . . . . 1.72 110.944 -178.505 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 48.3 t -127.84 133.9 66.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.056 -0.52 . . . . 1.08 109.692 175.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.408 ' HA ' ' O ' ' A' ' 54' ' ' SER . 5.6 t70 -75.03 134.0 41.51 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 120.91 0.386 . . . . 1.83 110.164 175.685 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.9 tttt . . . . . 0 C--N 1.317 -0.827 0 CA-C-N 116.084 -0.507 . . . . 2.76 110.323 -178.125 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.408 ' O ' ' HA ' ' A' ' 46' ' ' ASP . 21.7 p . . . . . 0 N--CA 1.45 -0.438 0 N-CA-C 110.471 -0.196 . . . . 1.71 110.471 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -118.8 132.43 56.13 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 121.014 -0.274 . . . . 1.15 110.86 -178.118 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -113.0 113.02 24.89 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 107.754 -1.202 . . . . 1.35 107.754 171.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.0 117.88 35.17 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.172 0.511 . . . . 0.51 112.251 -169.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 61.1 t -83.64 112.28 20.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.675 -0.693 . . . . 0.55 109.641 175.046 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.673 HG13 ' HA ' ' A' ' 94' ' ' CYS . 1.0 OUTLIER -100.53 140.02 20.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.254 -0.43 . . . . 1.18 110.502 -176.051 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.708 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 95.1 t -127.98 107.44 16.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 108.864 -0.791 . . . . 0.58 108.864 171.402 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.449 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 43.5 t -155.78 154.87 32.07 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.073 0.463 . . . . 0.84 112.028 -174.307 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.49 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 6.0 m-20 -67.07 -19.47 65.67 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 115.558 -0.747 . . . . 1.67 110.333 173.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -58.02 -30.47 66.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.608 -0.724 . . . . 1.81 111.031 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -94.73 -11.1 29.73 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.185 0.517 . . . . 3.19 110.665 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.49 ' HB3' ' HA ' ' A' ' 62' ' ' ASN . 0.6 OUTLIER -91.42 -16.13 27.83 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 108.643 -0.873 . . . . 2.14 108.643 -176.962 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -74.22 0.64 13.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.374 -0.83 . . . . 2.03 109.843 175.044 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 53.3 mmtt 64.98 37.81 6.67 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 114.837 -1.074 . . . . 3.31 110.864 175.459 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.89 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 42.3 mmtm -96.1 92.07 6.25 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.063 -0.517 . . . . 1.99 111.148 177.759 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.411 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 5.8 tt -73.64 -57.29 4.09 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.436 -0.579 . . . . 2.33 109.436 177.438 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.433 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -68.18 -32.26 72.37 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.043 -0.526 . . . . 1.09 111.448 -177.388 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.89 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 24.3 t70 -74.09 -38.65 63.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.363 -0.38 . . . . 2.08 111.431 -173.164 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.411 ' HG2' ' O ' ' A' ' 69' ' ' LEU . 50.9 ptt85 -62.63 -34.54 77.26 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.422 -0.511 . . . . 2.93 109.851 177.398 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 73.4 t60 -69.05 -46.6 67.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.271 -0.422 . . . . 1.21 110.53 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.527 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 3.7 ptm180 -68.17 -38.77 82.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.659 -0.246 . . . . 1.67 110.884 -178.377 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -65.67 -47.58 75.03 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.833 -0.167 . . . . 1.48 111.028 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.519 HG13 HD22 ' A' ' 80' ' ' LEU . 37.2 t -57.51 -45.4 85.94 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 CA-C-N 116.567 -0.288 . . . . 0.82 110.665 177.615 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.543 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 5.1 m-20 -67.35 -29.5 69.07 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.93 -0.308 . . . . 1.14 111.622 -179.031 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 91.5 m -66.25 -48.3 70.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.794 0.33 . . . . 0.69 111.019 -178.836 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 21.0 mt -81.8 -51.14 15.54 Favored 'Isoleucine or valine' 0 C--O 1.242 0.671 0 CA-C-O 121.952 0.882 . . . . 0.77 110.62 -177.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.954 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.3 mp -74.67 -0.13 16.97 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.195 -0.912 . . . . 0.78 111.27 -176.752 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.543 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 56.0 tptt -50.86 -63.71 1.04 Allowed 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 108.949 -0.76 . . . . 1.93 108.949 169.523 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -75.49 -35.68 60.76 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.906 -0.588 . . . . 2.91 110.968 176.662 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.954 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 30.7 tt0 -59.5 -41.18 89.29 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 111.868 0.321 . . . . 1.66 111.868 -175.796 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 41.0 mt -56.46 -30.68 63.2 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.185 0.439 . . . . 0.58 112.185 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -57.83 -18.23 20.97 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.72 0.295 . . . . 0.92 111.566 -174.756 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -100.27 -4.34 29.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.717 -0.22 . . . . 1.02 111.515 -177.37 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 6.1 mt -115.38 152.12 17.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 109.923 -0.399 . . . . 0.77 109.923 -177.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -84.43 -38.24 20.44 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.825 -0.435 . . . . 1.85 109.825 176.827 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -161.08 108.41 1.49 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.213 -0.449 . . . . 0.78 111.029 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -105.64 138.29 42.08 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.012 0.434 . . . . 0.63 110.869 176.129 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 44.5 m -134.61 158.84 43.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.872 -0.604 . . . . 1.27 109.485 175.828 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -137.0 147.56 46.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.22 0.533 . . . . 0.64 111.755 -176.274 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 48.7 mmtm -119.3 109.33 15.68 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.44 -0.8 . . . . 2.23 108.978 173.534 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.673 ' HA ' HG13 ' A' ' 59' ' ' ILE . 4.5 p -84.01 121.29 27.2 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.059 0.457 . . . . 1.38 111.315 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -131.79 153.88 49.67 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.333 0.587 . . . . 1.98 111.224 176.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 17.8 p -97.37 148.55 34.58 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.572 -0.74 . . . . 0.76 110.55 177.527 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -62.16 -30.25 81.86 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.621 2.214 . . . . 0.72 111.979 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.52 -51.34 60.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.667 -0.697 . . . . 2.08 109.965 -179.138 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.446 ' HA ' ' HE3' ' A' ' 102' ' ' LYS . 12.6 tp10 -72.57 -30.98 64.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.856 0.36 . . . . 2.69 110.489 -178.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -56.09 -35.21 66.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.864 -0.607 . . . . 1.46 111.595 -179.462 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -62.7 -36.57 83.37 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 121.094 -0.242 . . . . 1.23 111.031 -176.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.446 ' HE3' ' HA ' ' A' ' 99' ' ' GLU . 0.0 OUTLIER -66.62 -33.14 74.99 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.117 0.484 . . . . 2.66 110.495 178.16 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 69.1 mt . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 115.903 -0.589 . . . . 1.31 110.251 179.555 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 79.5 m . . . . . 0 N--CA 1.451 -0.404 0 N-CA-C 109.606 -0.516 . . . . 1.71 109.606 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.8 tp -54.8 -31.93 25.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 O-C-N 123.386 0.429 . . . . 1.37 111.414 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -58.6 -49.15 78.52 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.586 -0.279 . . . . 1.75 110.98 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.596 ' HE3' ' OE2' ' A' ' 30' ' ' GLU . 10.2 mmmm -70.91 -27.35 63.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.475 -0.33 . . . . 2.5 111.372 -177.025 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 81.8 t -58.82 -54.12 38.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.902 0.382 . . . . 1.04 110.067 176.368 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.509 HG12 HD11 ' A' ' 87' ' ' ILE . 1.8 mp -64.95 -48.78 82.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.615 -0.721 . . . . 0.79 110.509 178.336 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.596 ' OE2' ' HE3' ' A' ' 27' ' ' LYS . 27.1 tt0 -58.16 -52.21 66.5 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.966 -0.561 . . . . 2.2 111.461 -175.578 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -68.13 -31.98 71.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.542 -0.299 . . . . 1.67 111.299 -176.059 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -66.19 -55.66 15.18 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 120.588 0.233 . . . . 2.03 110.995 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 4.0 pp -72.8 -23.84 60.84 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.793 -0.363 . . . . 0.57 111.467 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.558 ' O ' ' HA ' ' A' ' 38' ' ' LYS . 22.7 t -69.08 -36.35 77.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.1 0.476 . . . . 1.29 110.131 176.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.3 m -71.68 -48.92 44.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.221 -0.445 . . . . 0.78 110.812 177.127 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.61 -54.76 6.84 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.614 0.598 . . . . 0.64 112.614 -173.545 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.8 mt -80.69 -33.41 35.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.937 0.398 . . . . 0.94 110.272 -177.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.558 ' HA ' ' O ' ' A' ' 34' ' ' SER . 18.7 ttmm 58.01 81.22 0.26 Allowed Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.045 -0.98 . . . . 3.36 112.154 174.801 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.697 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 5.4 Cg_endo -87.08 147.85 7.94 Favored 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 123.165 2.577 . . . . 0.63 112.197 178.321 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.22 -22.58 33.09 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.456 0.646 . . . . 0.73 109.794 176.122 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.679 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 64.4 t80 -141.63 127.6 19.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.235 -0.893 . . . . 0.76 109.156 171.164 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 48.6 tp -142.32 133.8 26.56 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.396 -0.366 . . . . 1.55 110.273 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -149.6 139.8 22.19 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.858 0.361 . . . . 2.23 110.536 174.401 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.416 HD22 ' N ' ' A' ' 44' ' ' LEU . 3.1 mm? -88.61 124.68 34.29 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.499 -0.556 . . . . 1.72 109.499 176.733 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 59.1 t -103.17 135.35 41.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.703 -0.48 . . . . 1.08 109.703 -178.424 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -69.41 105.01 2.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.905 -1.043 . . . . 1.83 111.082 -172.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.631 ' HE2' ' HB2' ' A' ' 56' ' ' ASP . 16.0 tppt? . . . . . 0 C--N 1.323 -0.554 0 CA-C-O 121.402 0.62 . . . . 2.76 109.705 179.344 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.5 m . . . . . 0 N--CA 1.448 -0.526 0 N-CA-C 109.968 -0.382 . . . . 1.71 109.968 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -136.39 143.36 43.95 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.592 -0.276 . . . . 1.15 110.481 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.631 ' HB2' ' HE2' ' A' ' 47' ' ' LYS . 38.7 t70 -122.0 115.27 22.22 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.016 -0.735 . . . . 1.35 109.016 175.798 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.03 119.42 39.14 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.026 0.441 . . . . 0.51 111.648 -171.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.514 ' HA ' ' HB2' ' A' ' 93' ' ' LYS . 62.2 t -75.71 111.25 11.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.229 -0.656 . . . . 0.55 109.229 175.223 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.521 HD11 ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER -113.67 110.53 32.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.911 0.862 . . . . 1.18 110.487 -176.782 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.679 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 98.2 t -107.81 106.44 20.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 114.747 -1.115 . . . . 0.58 108.945 175.596 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.697 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 40.4 t -151.55 155.13 37.84 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.344 0.592 . . . . 0.84 111.792 -173.118 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.526 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 6.1 m-20 -62.02 -19.23 62.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.971 -1.013 . . . . 1.67 111.66 176.269 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.439 ' OD1' ' HB3' ' A' ' 61' ' ' SER . 28.4 p-10 -63.78 -26.18 68.52 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.705 0.288 . . . . 1.81 111.285 -179.182 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.553 ' HD2' HG23 ' A' ' 96' ' ' THR . 59.6 t80 -90.63 -13.2 34.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.439 0.638 . . . . 3.19 109.674 176.586 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.526 ' HB3' ' HA ' ' A' ' 62' ' ' ASN . 0.9 OUTLIER -87.36 -11.03 50.54 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 108.878 -0.786 . . . . 2.14 108.878 -179.668 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -63.31 -19.46 64.62 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.029 -0.987 . . . . 2.03 110.451 178.335 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm 78.61 -28.28 0.16 Allowed 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.07 0.948 . . . . 3.31 111.883 176.297 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -71.24 100.03 2.02 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.929 0.395 . . . . 1.99 110.377 178.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.512 HD12 ' N ' ' A' ' 70' ' ' LEU . 4.0 pp -70.04 -36.31 74.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.277 -0.42 . . . . 2.33 111.432 -175.312 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.512 ' N ' HD12 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -67.79 -32.96 73.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.801 0.334 . . . . 1.09 110.942 178.951 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.522 ' HA ' ' HG2' ' A' ' 74' ' ' ARG . 7.2 m-20 -74.08 -37.73 64.13 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 120.888 0.375 . . . . 2.08 110.126 177.532 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -57.64 -43.3 84.77 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.377 -0.601 . . . . 2.93 109.377 172.315 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 30.7 t60 -63.42 -53.31 54.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.558 -0.746 . . . . 1.21 111.143 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.522 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 9.9 ptm180 -63.69 -36.6 84.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.3 -0.409 . . . . 1.67 111.6 -175.658 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -63.96 -49.48 72.34 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.77 0.319 . . . . 1.48 110.773 178.736 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 74.6 t -58.57 -42.82 85.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.069 -0.514 . . . . 0.82 110.297 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.536 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 6.2 m-20 -64.3 -35.41 80.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.297 -0.41 . . . . 1.14 111.45 179.372 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 86.8 m -62.2 -51.33 68.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.838 0.351 . . . . 0.69 111.446 -178.504 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.4 HD12 ' N ' ' A' ' 79' ' ' ILE . 2.9 mp -80.03 -48.88 19.87 Favored 'Isoleucine or valine' 0 C--O 1.241 0.617 0 CA-C-O 121.44 0.638 . . . . 0.77 110.927 -177.295 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.893 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.5 mp -74.94 -2.27 26.28 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.933 -0.576 . . . . 0.78 111.441 -175.206 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.536 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 56.9 tptt -51.6 -64.1 0.92 Allowed 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 109.497 -0.557 . . . . 1.93 109.497 171.208 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.423 ' HG3' ' N ' ' A' ' 83' ' ' GLU . 2.4 pt-20 -75.07 -33.68 61.71 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.001 -0.545 . . . . 2.91 110.867 176.319 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.893 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 5.2 tp10 -55.18 -53.6 53.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.193 0.521 . . . . 1.66 112.049 -175.767 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 70.3 mt -50.39 -30.67 12.91 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.269 -0.878 . . . . 0.58 112.472 178.717 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -57.21 -24.34 53.9 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.023 0.44 . . . . 0.92 110.733 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -91.67 -10.82 38.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.064 -0.517 . . . . 1.02 111.47 -175.349 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.509 HD11 HG12 ' A' ' 29' ' ' ILE . 3.1 mt -120.46 164.13 17.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.746 -0.464 . . . . 0.77 109.746 -176.667 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -92.24 -46.36 7.76 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.505 -0.554 . . . . 1.85 109.505 175.163 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -148.3 109.6 4.36 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.032 -0.531 . . . . 0.78 110.514 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -116.77 127.41 54.32 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.295 -0.412 . . . . 0.63 110.547 177.721 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 37.0 p -124.44 167.07 14.92 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.412 -0.588 . . . . 1.27 109.412 175.253 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -143.51 146.01 33.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.919 0.39 . . . . 0.64 111.132 -178.016 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.514 ' HB2' ' HA ' ' A' ' 58' ' ' VAL . 44.5 mmtm -97.42 109.35 22.12 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.003 -0.74 . . . . 2.23 109.003 174.623 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 3.9 p -89.9 111.56 22.65 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.062 -0.517 . . . . 1.38 111.018 -174.647 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.464 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 1.7 m80 -138.3 156.82 47.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.985 -0.552 . . . . 1.98 110.671 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.553 HG23 ' HD2' ' A' ' 64' ' ' PHE . 47.5 p -98.16 153.47 38.09 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.225 -0.443 . . . . 0.76 110.272 177.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -64.39 -22.21 66.09 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.35 2.033 . . . . 0.72 111.191 175.534 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.402 HD22 ' HA ' ' A' ' 98' ' ' LEU . 1.4 tm? -68.56 -44.0 75.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.262 -0.881 . . . . 2.08 109.411 177.716 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 57.0 tt0 -75.9 -35.63 59.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.473 -0.785 . . . . 2.69 110.132 178.224 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -58.43 -32.49 68.74 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.931 -0.577 . . . . 1.46 110.957 178.275 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -52.03 -36.28 49.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.11 -0.495 . . . . 1.23 111.589 177.472 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -77.57 -35.43 53.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.101 0.477 . . . . 2.66 110.167 178.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 66.3 mt . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.748 -0.66 . . . . 1.31 111.709 -173.755 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.444 ' O ' HG23 ' A' ' 28' ' ' VAL . 62.3 m . . . . . 0 C--O 1.233 0.215 0 CA-C-O 120.761 0.315 . . . . 1.71 111.391 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.1 tp -61.64 -38.39 80.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 116.165 -0.47 . . . . 1.37 111.757 -176.242 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.2 tt0 -59.3 -43.11 92.65 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.086 0.469 . . . . 1.75 110.504 177.07 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.405 ' HD3' ' O ' ' A' ' 27' ' ' LYS . 11.7 tmtt? -64.75 -34.55 78.6 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.532 -0.758 . . . . 2.5 109.808 -179.176 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 24' ' ' CYS . 93.6 t -61.71 -43.95 97.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.993 -0.549 . . . . 1.04 110.49 176.774 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.508 HG13 ' HG3' ' A' ' 83' ' ' GLU . 1.7 mp -67.22 -42.93 88.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.17 -0.468 . . . . 0.79 110.535 178.213 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.537 ' O ' ' HB2' ' A' ' 34' ' ' SER . 45.1 mt-10 -52.21 -50.38 62.05 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.44 -0.345 . . . . 2.2 111.036 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.465 ' HA ' ' HB3' ' A' ' 34' ' ' SER . 4.6 m-20 -78.79 -18.98 53.24 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.249 0.463 . . . . 1.67 112.249 -178.908 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.458 ' HE3' HG23 ' A' ' 79' ' ' ILE . 51.5 tptt -61.46 -55.74 27.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.804 0.335 . . . . 2.03 110.21 178.443 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.517 HD11 ' HG ' ' A' ' 42' ' ' LEU . 4.4 pp -73.68 -26.38 60.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.229 -0.442 . . . . 0.57 110.429 176.621 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.604 ' O ' ' HD2' ' A' ' 38' ' ' LYS . 4.7 t -63.7 -45.96 87.63 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 116.169 -0.468 . . . . 1.29 109.907 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.8 m -53.27 -27.89 24.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.955 0.407 . . . . 0.78 111.231 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.615 ' HB2' HG12 ' A' ' 79' ' ' ILE . . . -89.22 -43.35 11.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.937 -0.574 . . . . 0.64 112.316 -177.743 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.0 mp -107.06 -36.13 6.68 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.461 0.541 . . . . 0.94 112.461 -173.102 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.604 ' HD2' ' O ' ' A' ' 34' ' ' SER . 27.9 mmmt 51.01 75.3 0.67 Allowed Pre-proline 0 N--CA 1.468 0.443 0 C-N-CA 123.3 0.64 . . . . 3.36 110.845 -168.399 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -81.97 141.66 12.01 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.716 2.277 . . . . 0.63 112.391 -178.027 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.4 p -60.95 -35.05 75.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.594 -0.73 . . . . 0.73 111.182 179.567 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.687 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 72.4 t80 -138.36 124.09 19.82 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.477 -0.564 . . . . 0.76 109.477 175.874 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.517 ' HG ' HD11 ' A' ' 33' ' ' LEU . 3.3 tm? -142.54 122.62 13.71 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.748 -0.834 . . . . 1.55 108.748 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.527 ' O ' ' HA ' ' A' ' 57' ' ' ALA . 10.7 tp10 -143.24 140.48 30.7 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.673 -0.411 . . . . 2.23 111.039 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.481 HD13 ' HG2' ' A' ' 30' ' ' GLU . 10.6 mp -106.74 117.41 33.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.086 0.47 . . . . 1.72 110.771 178.793 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 52.9 t -106.22 119.26 55.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.73 -0.668 . . . . 1.08 109.956 176.754 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -73.52 122.84 22.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.998 -0.546 . . . . 1.83 110.101 177.801 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.7 mtmm . . . . . 0 C--N 1.324 -0.509 0 CA-C-N 116.283 -0.417 . . . . 2.76 110.719 -177.986 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.7 p . . . . . 0 N--CA 1.446 -0.655 0 N-CA-C 109.29 -0.634 . . . . 1.71 109.29 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -111.33 132.7 54.2 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.184 0.516 . . . . 1.15 110.747 -175.086 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -112.59 118.55 35.4 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.191 -0.913 . . . . 1.35 108.589 176.464 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.527 ' HA ' ' O ' ' A' ' 43' ' ' GLU . . . -105.68 115.6 30.52 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.999 0.428 . . . . 0.51 111.68 -173.404 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.413 ' O ' ' HA ' ' A' ' 42' ' ' LEU . 47.3 t -74.43 110.93 9.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 108.589 -0.893 . . . . 0.55 108.589 172.389 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -107.65 109.68 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 CA-C-O 121.862 0.839 . . . . 1.18 109.963 -177.687 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.687 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 60.2 t -111.26 105.21 18.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 115.026 -0.988 . . . . 0.58 110.088 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 88.2 p -156.75 142.18 17.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.231 0.539 . . . . 0.84 111.238 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.644 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 61.4 m-20 -67.69 -18.49 64.94 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.372 -0.831 . . . . 1.67 112.07 177.529 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -48.99 -36.83 18.53 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.878 0.371 . . . . 1.81 111.029 177.318 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.603 ' CE1' ' HA ' ' A' ' 72' ' ' ARG . 21.3 m-30 -101.59 21.4 14.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.955 0.407 . . . . 3.19 111.286 -178.631 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.644 ' HB3' ' O ' ' A' ' 62' ' ' ASN . 0.7 OUTLIER -92.95 -14.57 27.34 Favored 'General case' 0 N--CA 1.426 -1.658 0 N-CA-C 108.407 -0.96 . . . . 2.14 108.407 178.847 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -73.21 -4.02 30.39 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.365 -0.834 . . . . 2.03 109.916 178.759 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 99.2 mttt 67.45 25.32 8.57 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.359 -0.837 . . . . 3.31 111.888 172.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.524 ' HE2' HD11 ' A' ' 70' ' ' LEU . 13.5 mmmm -93.08 96.53 10.11 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.852 -0.613 . . . . 1.99 109.896 178.172 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.471 HD12 ' N ' ' A' ' 70' ' ' LEU . 4.3 pp -72.35 -33.16 67.08 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.968 -0.293 . . . . 2.33 110.977 -175.936 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.524 HD11 ' HE2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -67.88 -35.16 78.02 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 120.957 -0.297 . . . . 1.09 110.682 177.662 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.521 ' N ' HD22 ' A' ' 70' ' ' LEU . 23.0 m-20 -71.66 -45.32 62.32 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 109.567 -0.531 . . . . 2.08 109.567 175.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.603 ' HA ' ' CE1' ' A' ' 64' ' ' PHE . 0.5 OUTLIER -52.88 -48.07 67.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.476 -0.784 . . . . 2.93 110.033 175.497 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.6 t60 -65.94 -53.03 44.49 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.721 -0.672 . . . . 1.21 111.315 -177.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -67.04 -41.65 86.17 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 111.961 0.356 . . . . 1.67 111.961 -172.575 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.99 -49.98 70.33 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.929 0.395 . . . . 1.48 110.315 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.776 HG13 HD22 ' A' ' 80' ' ' LEU . 35.0 t -57.74 -46.55 86.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.701 -0.681 . . . . 0.82 110.635 178.188 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -61.84 -40.24 94.62 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.611 -0.268 . . . . 1.14 111.583 -178.201 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 74.8 m -60.99 -51.22 70.17 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 111.626 0.232 . . . . 0.69 111.626 -177.324 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.615 HG12 ' HB2' ' A' ' 36' ' ' ALA . 2.7 mp -81.12 -48.84 18.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 CA-C-O 120.9 0.381 . . . . 0.77 111.295 -176.088 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.86 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.0 mp -69.8 -7.44 39.83 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 116.208 -0.451 . . . . 0.78 111.669 -176.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -55.51 -59.71 4.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.273 0.559 . . . . 1.93 109.951 171.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -68.64 -37.38 79.65 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.608 -0.724 . . . . 2.91 110.178 177.357 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.86 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 32.9 tt0 -55.27 -41.22 71.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.743 -0.662 . . . . 1.66 111.285 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.727 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 57.3 mt -54.84 -30.99 58.88 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 123.082 0.553 . . . . 0.58 112.402 179.426 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -60.2 -18.49 48.65 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.734 0.302 . . . . 0.92 111.3 -174.149 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.503 ' HB2' HD11 ' A' ' 29' ' ' ILE . 25.8 m-80 -101.8 4.86 40.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.815 0.34 . . . . 1.02 110.929 -178.476 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 3.3 mt -127.32 163.81 29.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 110.102 -0.332 . . . . 0.77 110.102 -175.344 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -96.55 -52.23 4.02 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.619 -0.511 . . . . 1.85 109.619 173.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -144.4 101.15 3.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.922 -0.581 . . . . 0.78 110.311 177.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -93.31 141.47 28.4 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.279 -0.419 . . . . 0.63 110.944 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.5 m -138.38 163.58 31.5 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.742 -0.836 . . . . 1.27 108.742 175.032 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -146.06 151.56 37.92 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.57 -0.452 . . . . 0.64 111.61 -178.718 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -113.81 116.32 29.16 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.56 -0.746 . . . . 2.23 109.481 176.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 42.5 t -84.23 124.19 30.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.71 0.29 . . . . 1.38 110.724 -177.54 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.666 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 2.1 t60 -147.99 152.72 37.95 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.868 -0.419 . . . . 1.98 109.868 179.122 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.489 HG21 ' HB2' ' A' ' 65' ' ' GLU . 0.8 OUTLIER -102.19 151.89 38.16 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-O 120.76 0.314 . . . . 0.76 111.838 178.113 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -59.36 -48.04 14.96 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.999 2.466 . . . . 0.72 112.247 -177.366 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.29 -36.12 81.13 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.83 -0.623 . . . . 2.08 111.199 -177.179 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.562 ' HA ' ' CE ' ' A' ' 102' ' ' LYS . 20.1 tp10 -75.72 -38.51 58.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.773 0.32 . . . . 2.69 110.627 -178.849 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -65.38 -33.25 75.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.871 0.367 . . . . 1.46 110.093 176.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -54.48 -43.75 72.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.578 -0.737 . . . . 1.23 111.591 178.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.562 ' CE ' ' HA ' ' A' ' 99' ' ' GLU . 0.0 OUTLIER -61.99 -47.78 83.29 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 120.899 -0.32 . . . . 2.66 110.708 177.72 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 62.4 mt . . . . . 0 C--N 1.324 -0.513 0 CA-C-N 116.181 -0.463 . . . . 1.31 111.309 -176.003 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 34.7 m . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.599 0.238 . . . . 1.71 110.814 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.3 tp -55.01 -34.15 30.89 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 CA-C-N 116.201 -0.454 . . . . 1.37 111.157 -178.453 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 21.2 tm0? -58.83 -47.4 84.94 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.593 -0.276 . . . . 1.75 110.317 177.724 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.573 ' HA ' ' HB3' ' A' ' 30' ' ' GLU . 53.1 mttt -71.74 -17.82 62.17 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 116.426 -0.352 . . . . 2.5 111.671 -178.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 95.3 t -67.25 -51.1 56.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 109.174 -0.676 . . . . 1.04 109.174 174.415 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.591 ' HA ' ' OE2' ' A' ' 83' ' ' GLU . 2.0 mp -61.29 -51.33 74.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 115.135 -0.939 . . . . 0.79 109.646 174.559 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.573 ' HB3' ' HA ' ' A' ' 27' ' ' LYS . 34.1 tt0 -53.06 -51.77 60.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.303 -0.862 . . . . 2.2 111.564 -178.197 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -61.87 -45.52 93.41 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.974 -0.557 . . . . 1.67 111.799 -174.719 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -68.42 -47.52 67.03 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.378 -0.529 . . . . 2.03 112.24 -175.207 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.486 HD12 ' N ' ' A' ' 34' ' ' SER . 4.2 pp -70.8 -27.69 64.08 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.095 -0.642 . . . . 0.57 110.987 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.486 ' N ' HD12 ' A' ' 33' ' ' LEU . 46.5 t -66.66 -46.34 76.03 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.937 -0.394 . . . . 1.29 109.937 175.706 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.8 m -71.35 -27.73 63.56 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.297 -0.41 . . . . 0.78 111.337 -179.201 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.61 -43.17 20.96 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.082 0.401 . . . . 0.64 112.082 -176.571 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 85.8 mt -104.46 -38.05 6.95 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.724 0.268 . . . . 0.94 111.724 -174.709 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.3 mttm 53.6 90.37 0.09 OUTLIER Pre-proline 0 N--CA 1.467 0.384 0 CA-C-O 121.647 0.737 . . . . 3.36 112.642 -175.283 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.75 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 5.2 Cg_endo -87.74 158.73 7.62 Favored 'Trans proline' 0 N--CA 1.451 -1.022 0 C-N-CA 123.155 2.57 . . . . 0.63 112.047 175.024 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 21.6 p -82.77 -26.19 32.08 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.742 0.782 . . . . 0.73 109.031 173.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.57 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 91.6 t80 -140.1 132.33 28.17 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.695 -1.139 . . . . 0.76 109.268 173.542 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.571 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 59.3 tp -136.18 122.64 20.74 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.941 -0.392 . . . . 1.55 109.941 -179.063 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.519 ' HB3' ' HB ' ' A' ' 58' ' ' VAL . 34.9 tt0 -119.88 119.86 34.75 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.432 -0.349 . . . . 2.23 110.061 -179.284 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -104.09 115.85 31.16 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.023 -0.362 . . . . 1.72 110.023 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 50.1 t -121.91 124.71 71.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.632 -0.258 . . . . 1.08 110.762 -178.277 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -82.07 122.63 28.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.113 0.482 . . . . 1.83 109.984 174.875 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt . . . . . 0 C--N 1.319 -0.758 0 CA-C-N 115.874 -0.603 . . . . 2.76 110.538 -178.487 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.526 ' HB3' ' O ' ' A' ' 89' ' ' ALA . 68.6 m . . . . . 0 N--CA 1.45 -0.431 0 N-CA-C 108.969 -0.752 . . . . 1.71 108.969 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.463 ' HB2' ' CD1' ' A' ' 90' ' ' PHE . 81.2 m-85 -111.57 132.66 54.39 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.599 0.714 . . . . 1.15 111.385 -170.362 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -110.81 113.85 26.75 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 107.702 -1.221 . . . . 1.35 107.702 173.165 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.34 116.12 31.39 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.298 0.571 . . . . 0.51 111.382 -173.17 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.519 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 44.8 t -83.61 111.12 19.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 108.791 -0.818 . . . . 0.55 108.791 174.462 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.438 HG23 ' HA ' ' A' ' 94' ' ' CYS . 0.0 OUTLIER -110.14 107.84 23.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 121.876 0.846 . . . . 1.18 110.553 -176.207 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.57 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 94.4 t -107.72 108.01 24.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 114.86 -1.063 . . . . 0.58 109.013 176.253 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.75 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 45.2 t -151.36 154.78 37.35 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.254 0.549 . . . . 0.84 112.112 -173.175 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.491 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 91.3 m-20 -66.53 -19.44 65.78 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.233 -0.894 . . . . 1.67 110.27 174.126 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -64.69 -20.79 66.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.916 -0.584 . . . . 1.81 110.537 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -110.47 7.01 22.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.36 0.6 . . . . 3.19 110.042 178.103 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.491 ' HB3' ' O ' ' A' ' 62' ' ' ASN . 0.5 OUTLIER -76.69 -28.34 55.88 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 109.347 -0.612 . . . . 2.14 109.347 -177.008 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -71.72 -8.57 54.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.815 -0.63 . . . . 2.03 110.225 172.402 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 54.6 mttp 65.73 29.44 10.7 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.384 -0.826 . . . . 3.31 112.165 171.613 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.443 ' HB3' ' OD2' ' A' ' 71' ' ' ASP . 14.2 mmmm -90.71 96.11 10.48 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.024 0.44 . . . . 1.99 109.974 175.571 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.444 HD12 ' N ' ' A' ' 70' ' ' LEU . 3.8 pp -73.48 -36.77 65.86 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.98 -0.555 . . . . 2.33 111.521 -174.825 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.455 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.87 -32.26 72.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.717 0.294 . . . . 1.09 110.972 178.496 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.455 ' N ' HD22 ' A' ' 70' ' ' LEU . 4.1 m-20 -66.84 -49.39 65.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.914 0.388 . . . . 2.08 110.666 -179.533 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.43 ' HG3' ' O ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -66.08 -26.83 67.66 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.827 -0.349 . . . . 2.93 110.344 178.724 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -69.51 -50.03 49.01 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 116.278 -0.419 . . . . 1.21 111.001 -179.723 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 11.6 ptm180 -66.7 -36.31 82.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.66 -0.245 . . . . 1.67 111.169 -178.418 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.84 -50.59 55.83 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 120.711 0.291 . . . . 1.48 111.034 177.808 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.539 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 8.9 p -61.77 -35.4 67.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.298 0 CA-C-N 116.496 -0.32 . . . . 0.82 110.25 -179.087 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.601 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 5.3 m-20 -69.62 -33.66 72.96 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.625 -0.261 . . . . 1.14 110.996 177.741 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 66.8 m -59.48 -51.72 68.66 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.707 0.289 . . . . 0.69 111.344 179.564 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.0 mp -83.18 -47.55 18.2 Favored 'Isoleucine or valine' 0 C--O 1.244 0.796 0 CA-C-O 121.681 0.753 . . . . 0.77 111.149 -177.835 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.805 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.3 mp -77.31 -0.45 25.54 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.176 -0.466 . . . . 0.78 112.121 -173.679 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.601 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 56.9 tptt -58.68 -57.77 11.54 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.26 -0.644 . . . . 1.93 109.26 171.824 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -72.15 -34.12 68.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.3 -0.863 . . . . 2.91 109.99 177.43 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.805 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.7 tp10 -54.86 -51.03 67.21 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.628 -0.714 . . . . 1.66 112.468 178.543 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.732 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 52.7 mt -50.35 -30.42 12.15 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.283 -0.871 . . . . 0.58 113.252 -176.759 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -53.73 -19.63 4.43 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.269 0.47 . . . . 0.92 112.269 -174.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -101.86 -4.0 27.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.77 0.319 . . . . 1.02 111.54 -177.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.498 HD11 HG12 ' A' ' 29' ' ' ILE . 12.6 mt -114.94 151.7 16.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.482 -0.326 . . . . 0.77 110.136 -174.906 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -84.99 -55.23 4.16 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.804 -0.358 . . . . 1.85 110.099 177.491 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.526 ' O ' ' HB3' ' A' ' 54' ' ' SER . . . -144.16 91.22 2.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.937 0.399 . . . . 0.78 111.185 178.292 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' PHE . . . . . 0.463 ' CD1' ' HB2' ' A' ' 55' ' ' PHE . 63.7 t80 -86.4 141.41 29.18 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.323 -0.399 . . . . 0.63 110.002 177.067 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 8.8 m -141.04 158.56 43.77 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.372 -0.603 . . . . 1.27 109.372 177.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -138.65 147.14 42.51 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.932 0.396 . . . . 0.64 111.124 -179.366 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -115.97 109.54 17.71 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.664 -0.698 . . . . 2.23 109.725 175.825 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.438 ' HA ' HG23 ' A' ' 59' ' ' ILE . 7.9 p -85.6 123.82 31.45 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.719 0.295 . . . . 1.38 110.623 -177.707 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.485 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 3.3 m-70 -144.0 160.52 40.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.165 0.507 . . . . 1.98 110.99 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.424 ' CG2' ' HA ' ' A' ' 65' ' ' GLU . 11.5 p -102.75 153.69 38.03 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 115.489 -0.778 . . . . 0.76 111.132 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -58.12 -28.76 84.9 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.721 2.281 . . . . 0.72 111.69 175.104 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.53 -47.16 76.75 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.896 -0.593 . . . . 2.08 110.285 177.599 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -67.05 -51.82 49.82 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.629 -0.714 . . . . 2.69 110.657 179.38 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -62.11 -32.39 72.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.917 -0.583 . . . . 1.46 110.966 -176.188 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -55.42 -33.24 63.37 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.035 -0.53 . . . . 1.23 111.072 178.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.42 ' N ' ' HE3' ' A' ' 102' ' ' LYS . 0.6 OUTLIER -76.55 -43.51 38.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.971 0.415 . . . . 2.66 110.223 176.8 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 86.2 mt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 115.799 -0.637 . . . . 1.31 111.492 -175.838 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.509 ' O ' HG23 ' A' ' 28' ' ' VAL . 42.4 t . . . . . 0 N--CA 1.454 -0.232 0 N-CA-C 108.646 -0.872 . . . . 1.71 108.646 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.552 ' O ' HG12 ' A' ' 29' ' ' ILE . 8.7 tp -53.07 -38.2 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 O-C-N 123.501 0.501 . . . . 1.37 111.626 -175.531 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -62.01 -52.26 64.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.807 0.337 . . . . 1.75 110.614 179.267 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -64.97 -31.45 72.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.101 -0.5 . . . . 2.5 110.774 -178.457 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 24' ' ' CYS . 89.5 t -61.79 -46.45 96.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 110.125 -0.324 . . . . 1.04 110.125 175.742 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.599 HG21 HD11 ' A' ' 87' ' ' ILE . 51.3 mm -63.14 -43.07 98.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.132 -0.486 . . . . 0.79 110.342 177.283 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -54.18 -51.94 62.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.982 -0.553 . . . . 2.2 111.005 177.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.418 ' HA ' ' HG ' ' A' ' 34' ' ' SER . 16.5 t70 -67.65 -34.55 77.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.183 0.516 . . . . 1.67 111.007 -179.55 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.541 ' HG2' ' OE1' ' A' ' 83' ' ' GLU . 13.5 tptp -60.18 -55.89 28.31 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.517 -0.765 . . . . 2.03 111.388 -177.423 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -74.16 -29.76 61.93 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.984 -0.286 . . . . 0.57 111.722 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.418 ' HG ' ' HA ' ' A' ' 31' ' ' ASP . 73.6 p -72.04 -33.4 67.97 Favored 'General case' 0 C--O 1.224 -0.248 0 C-N-CA 121.089 -0.244 . . . . 1.29 111.241 -177.812 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.2 m -65.79 -27.32 68.19 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.826 0.346 . . . . 0.78 111.042 176.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.29 -49.47 6.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.385 -0.37 . . . . 0.64 111.672 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.6 mt -83.11 -30.15 28.16 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.855 0.317 . . . . 0.94 111.855 -177.239 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 16.3 mmtm 55.68 81.82 0.25 Allowed Pre-proline 0 N--CA 1.466 0.329 0 C-N-CA 123.175 0.59 . . . . 3.36 112.331 -176.765 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.589 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 69.0 Cg_endo -92.62 139.23 1.81 Allowed 'Trans proline' 0 N--CA 1.448 -1.195 0 C-N-CA 122.887 2.392 . . . . 0.63 111.947 174.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 13.7 p -68.41 -32.5 72.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.22 0.533 . . . . 0.73 110.298 176.111 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.502 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 69.1 t80 -141.97 131.76 24.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.491 -0.777 . . . . 0.76 109.472 176.588 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.7 tp -141.87 112.87 7.41 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.756 0.312 . . . . 1.55 110.535 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -125.74 139.17 53.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.493 -0.321 . . . . 2.23 110.322 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.5 ' HG ' ' HB2' ' A' ' 57' ' ' ALA . 7.2 mp -117.12 122.41 44.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.541 -0.3 . . . . 1.72 110.497 -178.434 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.507 HG23 ' HB3' ' A' ' 56' ' ' ASP . 9.6 m -112.75 150.79 14.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.017 0.437 . . . . 1.08 111.135 178.115 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -78.28 119.58 21.84 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.793 -0.64 . . . . 1.83 110.235 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 21.5 ttmm . . . . . 0 C--N 1.324 -0.534 0 CA-C-N 116.223 -0.444 . . . . 2.76 109.862 -179.893 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.0 p . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 120.733 0.301 . . . . 1.71 110.711 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -111.63 132.74 54.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.415 -0.357 . . . . 1.15 110.621 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.507 ' HB3' HG23 ' A' ' 45' ' ' VAL . 5.2 t70 -107.76 110.37 22.17 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.33 -0.619 . . . . 1.35 109.33 179.08 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.5 ' HB2' ' HG ' ' A' ' 44' ' ' LEU . . . -106.17 115.8 30.84 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.99 0.424 . . . . 0.51 111.315 -177.946 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 56.2 t -82.02 111.18 18.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.81 -0.632 . . . . 0.55 109.32 175.427 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.431 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -104.41 108.8 25.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.667 0.746 . . . . 1.18 110.13 -176.971 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.612 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 60.4 t -106.5 106.67 21.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.175 -0.92 . . . . 0.58 109.27 177.13 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.589 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 30.0 t -142.31 147.93 37.17 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.012 0.434 . . . . 0.84 112.081 -174.158 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.626 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 25.0 m120 -67.13 -20.68 65.8 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.5 -0.773 . . . . 1.67 110.891 174.392 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -61.51 -23.96 66.28 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.939 -0.573 . . . . 1.81 111.154 -177.664 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -100.65 -5.3 26.82 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.476 -0.329 . . . . 3.19 111.477 -175.808 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.626 ' HG2' ' O ' ' A' ' 62' ' ' ASN . 7.7 pt-20 -77.58 -2.17 34.42 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 120.401 -0.52 . . . . 2.14 111.457 -174.11 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -92.86 4.49 53.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.227 0.536 . . . . 2.03 109.939 176.776 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt 71.82 15.21 5.85 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.18 -0.918 . . . . 3.31 111.062 175.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.427 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 44.0 mmtm -76.39 89.7 3.21 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.195 0.522 . . . . 1.99 110.963 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -73.92 -50.01 22.09 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.609 -0.723 . . . . 2.33 109.899 179.158 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.521 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.61 -34.58 77.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.117 -0.492 . . . . 1.09 111.215 -175.754 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.521 ' N ' HD22 ' A' ' 70' ' ' LEU . 9.4 t70 -73.76 -37.03 65.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.316 0.579 . . . . 2.08 109.878 -178.559 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.425 ' O ' HG23 ' A' ' 76' ' ' VAL . 1.3 tmt_? -63.42 -41.88 98.71 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.752 -0.658 . . . . 2.93 110.018 172.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -63.02 -47.01 84.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.089 -0.505 . . . . 1.21 111.155 -178.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 3.5 ptm180 -66.18 -35.66 81.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.466 -0.334 . . . . 1.67 110.963 -177.75 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.84 -48.34 71.96 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 110.244 -0.28 . . . . 1.48 110.244 176.337 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.531 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 64.6 t -56.92 -42.49 78.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.083 -0.508 . . . . 0.82 110.678 177.292 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.407 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 5.1 m-20 -64.91 -42.95 94.31 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.989 -0.284 . . . . 1.14 111.548 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 57.4 m -65.92 -49.09 69.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.03 0.443 . . . . 0.69 111.349 -176.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.428 ' HB ' HD12 ' A' ' 80' ' ' LEU . 35.1 mt -72.4 -53.37 19.66 Favored 'Isoleucine or valine' 0 C--O 1.241 0.643 0 CA-C-O 121.742 0.782 . . . . 0.77 110.708 -178.329 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 1.053 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.4 mp -79.57 -0.31 33.05 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.175 -0.92 . . . . 0.78 111.965 -172.435 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 17.8 tppt? -53.81 -63.92 0.99 Allowed 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.475 -0.49 . . . . 1.93 109.688 173.066 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -75.76 -33.08 60.21 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.096 -0.502 . . . . 2.91 110.884 173.623 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 1.053 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 1.8 tp10 -52.83 -52.88 55.35 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.787 0.327 . . . . 1.66 111.683 -177.87 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 61.9 mt -50.49 -30.83 13.71 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.48 -0.782 . . . . 0.58 112.465 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -57.81 -22.38 47.15 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 120.745 0.307 . . . . 0.92 111.077 -177.136 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -90.47 -7.01 54.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.811 0.338 . . . . 1.02 111.174 -178.502 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.599 HD11 HG21 ' A' ' 29' ' ' ILE . 6.9 mt -123.72 135.45 63.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.504 -0.316 . . . . 0.77 110.498 -174.283 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -69.33 -46.74 66.34 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.561 -0.533 . . . . 1.85 109.561 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -151.94 101.36 2.73 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.239 -0.437 . . . . 0.78 110.947 178.162 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' PHE . . . . . 0.506 ' HB2' HG21 ' A' ' 87' ' ' ILE . 79.1 t80 -103.01 139.28 38.77 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.944 0.402 . . . . 0.63 111.028 178.784 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.7 m -135.19 149.49 49.94 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.32 -0.622 . . . . 1.27 109.32 174.45 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -134.42 134.23 41.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.106 0.479 . . . . 0.64 111.105 -178.738 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -106.48 116.74 32.46 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.805 -0.634 . . . . 2.23 109.377 177.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 7.2 p -83.62 129.39 34.96 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.016 0.436 . . . . 1.38 111.613 -175.552 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.612 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 0.1 OUTLIER -145.09 158.23 43.88 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.802 -0.636 . . . . 1.98 109.67 176.063 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.403 ' HA ' ' HD3' ' A' ' 97' ' ' PRO . 0.6 OUTLIER -112.03 153.99 44.39 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 116.413 -0.358 . . . . 0.76 111.627 -178.507 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 97' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 96' ' ' THR . 27.5 Cg_exo -61.89 -26.86 79.48 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 123.11 2.54 . . . . 0.72 112.724 -176.241 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 98' ' ' LEU . 1.2 tm? -62.45 -51.41 67.62 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.777 -0.453 . . . . 2.08 109.777 -178.868 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.563 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 6.4 mp0 -66.82 -38.8 87.17 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.38 -0.373 . . . . 2.69 111.0 177.168 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -59.42 -39.72 84.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.586 -0.279 . . . . 1.46 111.05 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -58.46 -34.43 70.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 1.23 110.524 179.246 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.703 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.6 OUTLIER -76.44 -35.47 58.48 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.399 -0.364 . . . . 2.66 110.537 178.455 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.563 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 69.8 mt . . . . . 0 N--CA 1.463 0.206 0 CA-C-N 115.94 -0.573 . . . . 1.31 111.396 -178.109 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 37.8 m . . . . . 0 N--CA 1.451 -0.401 0 N-CA-C 109.788 -0.449 . . . . 1.71 109.788 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 11.2 tp -61.24 -32.03 51.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.611 0.243 . . . . 1.37 110.899 -176.809 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.461 ' HA ' ' OE1' ' A' ' 26' ' ' GLN . 6.4 tp60 -63.14 -37.2 86.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.97 0.414 . . . . 1.75 110.683 179.392 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -71.59 -33.8 69.33 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.226 -0.443 . . . . 2.5 110.054 177.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.43 HG12 ' HE3' ' A' ' 32' ' ' LYS . 62.2 t -61.45 -50.91 78.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.968 -0.56 . . . . 1.04 110.194 177.27 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.483 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.7 mp -58.39 -50.21 79.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.804 -0.635 . . . . 0.79 110.149 176.474 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -53.46 -52.03 60.81 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.727 -0.669 . . . . 2.2 111.579 -178.103 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.8 -42.22 77.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 1.67 112.138 -173.148 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.43 ' HE3' HG12 ' A' ' 28' ' ' VAL . 8.4 mtmp? -66.88 -45.71 77.19 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.595 -0.442 . . . . 2.03 111.564 -175.127 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 4.5 pp -72.31 -28.27 62.97 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.197 -0.601 . . . . 0.57 110.999 177.662 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.443 ' N ' HD12 ' A' ' 33' ' ' LEU . 46.3 t -66.0 -41.82 90.56 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.982 0.42 . . . . 1.29 109.901 175.886 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.7 m -66.93 -27.65 67.65 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.111 0.482 . . . . 0.78 110.686 179.021 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.496 ' HB2' HG12 ' A' ' 79' ' ' ILE . . . -77.15 -53.91 7.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.807 -0.633 . . . . 0.64 111.87 -178.613 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.3 mt -86.79 -26.38 24.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.439 -0.346 . . . . 0.94 111.465 -174.189 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.2 tttp 56.67 75.12 0.6 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.771 -0.65 . . . . 3.36 110.964 -176.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.539 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 23.5 Cg_endo -94.45 144.47 1.66 Allowed 'Trans proline' 0 N--CA 1.448 -1.154 0 C-N-CA 123.29 2.66 . . . . 0.63 112.566 179.141 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 23.9 p -80.58 -23.76 39.66 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.424 0.63 . . . . 0.73 109.489 174.763 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.775 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 76.5 t80 -139.25 125.21 19.81 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.005 -0.998 . . . . 0.76 109.248 175.272 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -142.23 118.73 10.94 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.323 -0.621 . . . . 1.55 109.323 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -131.55 131.89 43.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.518 -0.31 . . . . 2.23 110.908 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -89.55 115.59 27.07 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.975 -0.75 . . . . 1.72 108.975 176.004 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 44.6 t -107.17 132.21 55.19 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.024 0.44 . . . . 1.08 111.502 -175.222 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.28 100.93 0.38 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.515 -0.766 . . . . 1.83 109.255 172.177 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.515 ' HD3' ' HB3' ' A' ' 56' ' ' ASP . 27.4 tptt . . . . . 0 C--N 1.324 -0.538 0 CA-C-O 121.013 0.435 . . . . 2.76 109.985 -176.002 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.0 m . . . . . 0 N--CA 1.451 -0.407 0 N-CA-C 110.142 -0.318 . . . . 1.71 110.142 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -111.55 132.42 54.54 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.719 -0.845 . . . . 1.15 108.719 175.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.515 ' HB3' ' HD3' ' A' ' 47' ' ' LYS . 35.1 t70 -115.56 125.94 53.6 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.947 -0.39 . . . . 1.35 109.947 -175.183 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.15 115.95 31.1 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.199 0.523 . . . . 0.51 111.273 -174.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 62.0 t -78.09 111.85 15.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.391 -0.822 . . . . 0.55 109.061 174.544 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.543 ' CG1' ' HA ' ' A' ' 94' ' ' CYS . 0.9 OUTLIER -105.16 133.89 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-O 121.234 0.54 . . . . 1.18 110.356 -177.559 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.775 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 96.9 t -124.91 101.48 8.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 N-CA-C 108.618 -0.882 . . . . 0.58 108.618 172.125 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.539 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 37.1 t -151.7 154.97 37.37 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.186 -0.461 . . . . 0.84 111.376 -173.211 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -67.46 -18.97 65.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.935 -0.575 . . . . 1.67 110.519 174.6 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -63.42 -1.93 1.34 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 122.804 0.442 . . . . 1.81 112.022 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.594 ' HD2' HG23 ' A' ' 96' ' ' THR . 51.6 t80 -109.69 -7.14 15.12 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.983 -0.448 . . . . 3.19 111.528 179.643 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -75.5 -18.2 59.9 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.688 -0.405 . . . . 2.14 111.606 -171.368 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.5 ' O ' ' HG2' ' A' ' 67' ' ' LYS . 8.7 m-20 -75.59 -15.41 60.36 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.828 -0.169 . . . . 2.03 110.847 175.49 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 66' ' ' ASP . 62.3 pttt 53.6 13.85 0.53 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.759 1.224 . . . . 3.31 113.21 178.482 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -78.82 125.32 29.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.209 0.528 . . . . 1.99 111.276 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 28.0 tp -69.7 -56.67 6.57 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.311 -0.858 . . . . 2.33 111.1 -179.374 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.98 -31.16 72.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.717 -0.674 . . . . 1.09 112.125 -171.858 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.418 ' O ' ' HG2' ' A' ' 74' ' ' ARG . 12.4 t70 -73.76 -45.46 51.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.056 0.455 . . . . 2.08 110.636 -174.626 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 72' ' ' ARG . 12.9 ptt180 -72.49 -31.78 65.65 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.658 -0.497 . . . . 2.93 109.658 178.585 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -60.67 -50.93 71.54 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.086 -0.506 . . . . 1.21 110.349 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.418 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 6.2 ptm180 -63.88 -40.46 96.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.52 -0.309 . . . . 1.67 111.23 -178.647 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 89.0 mt -65.09 -50.24 66.89 Favored 'General case' 0 C--O 1.243 0.715 0 CA-C-O 121.122 0.486 . . . . 1.48 110.754 179.529 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.538 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 47.1 t -55.65 -45.34 78.99 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.586 0 CA-C-N 115.494 -0.776 . . . . 0.82 110.568 178.093 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.405 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 86.4 m-20 -66.96 -27.37 67.4 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 121.007 -0.277 . . . . 1.14 111.431 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 96.4 m -63.19 -54.02 44.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.541 0.21 . . . . 0.69 110.943 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.496 HG12 ' HB2' ' A' ' 36' ' ' ALA . 3.3 mp -82.19 -42.29 18.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 CA-C-O 121.63 0.728 . . . . 0.77 111.006 -178.646 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.878 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.5 mp -76.49 -0.99 25.04 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.041 -0.527 . . . . 0.78 111.757 -176.805 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 51.5 tptt -51.56 -63.37 1.15 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.379 -0.6 . . . . 1.93 109.379 169.503 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -74.63 -34.9 62.88 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.162 -0.472 . . . . 2.91 110.989 176.3 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.878 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 5.5 tp10 -52.55 -55.4 22.48 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.387 0.613 . . . . 1.66 111.975 -178.537 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 65.8 mt -50.51 -30.87 13.92 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 115.174 -0.921 . . . . 0.58 112.756 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -56.64 -23.15 39.37 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.901 0.381 . . . . 0.92 111.098 -176.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -96.54 -1.19 47.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.132 -0.485 . . . . 1.02 111.447 -176.22 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 6.9 mt -127.78 142.32 44.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 110.409 -0.219 . . . . 0.77 110.409 -177.191 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 86.0 t60 -69.98 -56.8 6.04 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.657 -0.417 . . . . 1.85 110.029 175.034 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -143.07 104.09 4.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.119 -0.491 . . . . 0.78 110.533 179.329 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -92.15 133.27 35.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.15 0.5 . . . . 0.63 110.811 177.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 42.5 t -121.04 155.73 33.73 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.178 -0.675 . . . . 1.27 109.178 177.752 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -143.51 138.97 29.57 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.867 0.365 . . . . 0.64 110.585 -177.849 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -112.47 109.06 18.43 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.562 -0.533 . . . . 2.23 109.562 174.565 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.543 ' HA ' ' CG1' ' A' ' 59' ' ' ILE . 37.6 m -84.01 111.65 19.48 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.829 -0.623 . . . . 1.38 110.863 -174.256 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -132.05 157.69 43.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.091 0.472 . . . . 1.98 111.063 177.041 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.594 HG23 ' HD2' ' A' ' 64' ' ' PHE . 48.0 p -102.52 159.54 29.04 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.174 -0.467 . . . . 0.76 110.339 176.789 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' PRO . . . . . 0.536 ' HG2' HD22 ' A' ' 98' ' ' LEU . 18.3 Cg_endo -60.71 -37.26 80.28 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.582 2.188 . . . . 0.72 111.928 177.363 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.536 HD22 ' HG2' ' A' ' 97' ' ' PRO . 2.9 mm? -69.67 -32.64 71.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.109 -0.496 . . . . 2.08 110.362 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 76.6 tt0 -72.17 -50.8 24.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.086 0.47 . . . . 2.69 110.028 177.184 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -62.94 -35.21 79.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.762 -0.654 . . . . 1.46 111.607 -176.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -60.74 -33.0 72.26 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.873 0.368 . . . . 1.23 111.372 -178.6 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.639 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -78.18 -22.54 48.48 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.851 0.357 . . . . 2.66 110.638 177.729 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 91.2 mt . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 116.204 -0.453 . . . . 1.31 111.092 -178.704 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.2 tpp . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 110.034 -0.358 . . . . 36.14 110.034 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 165.46 -124.08 1.21 Allowed Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 111.622 -0.591 . . . . 33.7 111.622 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.3 m 62.63 25.77 15.31 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.643 0.377 . . . . 32.35 111.678 177.256 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.7 t -90.44 111.3 22.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.146 0.498 . . . . 30.38 110.914 -178.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -146.97 95.82 2.64 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.138 -0.69 . . . . 28.39 109.138 174.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -90.91 138.39 31.63 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.912 -0.585 . . . . 28.54 111.457 -172.26 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.5 p-80 -86.04 75.42 9.95 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.825 0.821 . . . . 26.47 110.329 175.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 74.0 t60 -72.95 122.39 21.61 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.87 -1.059 . . . . 24.34 109.835 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 39.0 m170 -72.42 -65.84 0.73 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.012 0.434 . . . . 23.8 110.888 -174.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -166.46 123.29 1.3 Allowed 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.742 -0.836 . . . . 20.9 108.742 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.3 m -53.49 -53.91 44.68 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 123.528 0.518 . . . . 19.89 112.374 -170.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.9 m 58.33 48.1 12.96 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.483 0.659 . . . . 17.26 109.537 -178.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -168.52 -29.38 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 CA-C-N 115.316 -0.856 . . . . 16.67 112.832 -176.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 47.3 mtp180 -97.12 -30.7 12.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.571 0.701 . . . . 19.13 109.324 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -87.72 19.76 3.3 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.929 -1.032 . . . . 14.57 111.005 -177.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -71.21 -1.86 14.02 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.14 -0.482 . . . . 15.4 111.691 -175.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.9 mp -82.16 -22.79 35.89 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.421 -0.354 . . . . 16.35 111.454 -178.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 40.0 m-85 -95.54 131.77 41.37 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.421 0.629 . . . . 15.41 112.061 -176.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -95.67 12.65 29.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.878 -1.055 . . . . 11.39 110.9 -178.193 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.407 ' O ' ' HG2' ' A' ' 27' ' ' LYS . 52.8 mt-30 -82.98 31.31 0.43 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.729 -0.668 . . . . 10.77 111.674 -175.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.33 0.11 89.37 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.983 -0.627 . . . . 6.73 111.995 176.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 61.1 t60 -79.26 131.33 36.13 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.822 -0.436 . . . . 6.08 109.822 177.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.2 mmt -61.79 122.24 14.89 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.481 0.658 . . . . 4.41 111.913 -174.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.9 t -161.01 168.15 25.06 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.759 -1.11 . . . . 1.71 108.378 -178.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.8 tp -56.7 -35.77 46.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 120.874 0.369 . . . . 1.37 110.855 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -65.91 -40.09 91.17 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.255 -0.429 . . . . 1.75 110.544 178.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.601 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -61.49 -40.91 96.26 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.787 -0.642 . . . . 2.5 110.447 -178.704 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 54.8 t -63.47 -55.38 23.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.9 -0.591 . . . . 1.04 110.857 -178.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.7 mp -58.22 -47.42 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.112 -0.494 . . . . 0.79 110.878 -179.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.18 -51.26 68.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.085 -0.507 . . . . 2.2 111.121 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -66.9 -34.51 77.94 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.479 -0.328 . . . . 1.67 111.33 -176.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.468 ' HB3' ' NZ ' ' A' ' 32' ' ' LYS . 10.1 mtpm? -63.5 -55.47 23.8 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 111.836 0.31 . . . . 2.03 111.836 -177.723 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.441 HD12 ' N ' ' A' ' 34' ' ' SER . 3.8 pp -70.46 -28.42 64.99 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.896 -0.322 . . . . 0.57 111.058 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.441 ' N ' HD12 ' A' ' 33' ' ' LEU . 19.6 t -65.37 -39.5 92.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.931 0.396 . . . . 1.29 110.558 178.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.1 m -67.83 -28.07 67.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.387 -0.37 . . . . 0.78 111.363 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.11 -54.96 3.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.309 -0.405 . . . . 0.64 111.961 -174.292 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.53 HD13 ' HZ ' ' A' ' 64' ' ' PHE . 65.9 mt -87.94 -16.72 33.04 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.707 0.289 . . . . 0.94 111.06 -175.263 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.5 mttp 49.55 76.39 0.55 Allowed Pre-proline 0 C--O 1.235 0.324 0 CA-C-N 115.348 -0.842 . . . . 3.36 112.635 178.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.479 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 51.5 Cg_endo -89.27 126.68 1.64 Allowed 'Trans proline' 0 N--CA 1.447 -1.259 0 C-N-CA 122.687 2.258 . . . . 0.63 111.769 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.3 p -63.16 -25.54 68.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.118 0.485 . . . . 0.73 110.966 177.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.693 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 89.3 t80 -141.76 141.62 33.23 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.617 -0.72 . . . . 0.76 109.491 175.639 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 45.7 tp -142.16 116.83 9.76 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.977 -0.379 . . . . 1.55 109.977 178.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.506 ' HB3' ' HB ' ' A' ' 58' ' ' VAL . 5.7 tp10 -105.47 130.05 53.63 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 110.036 -0.357 . . . . 2.23 110.036 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.9 mp -118.44 115.8 25.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.116 0.484 . . . . 1.72 110.82 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 44.1 t -122.13 144.04 32.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.861 -0.609 . . . . 1.08 110.108 179.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -72.67 115.01 11.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.134 0.492 . . . . 1.83 110.602 176.108 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.516 ' O ' ' HB2' ' A' ' 54' ' ' SER . 0.0 OUTLIER -131.64 78.88 1.85 Allowed 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 107.794 -1.187 . . . . 2.76 107.794 174.481 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.591 ' HA ' ' HB2' ' A' ' 54' ' ' SER . 50.3 m -66.32 129.79 41.03 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.179 -0.919 . . . . 3.2 111.052 -174.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 42.2 t -67.76 -22.45 65.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.739 -0.664 . . . . 4.74 110.58 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 139.39 -37.42 1.75 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.966 -0.635 . . . . 3.16 111.53 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.8 t -109.03 98.48 7.94 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.871 0.367 . . . . 4.36 110.033 177.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.75 178.49 50.44 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.989 -0.625 . . . . 2.26 112.801 177.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.2 m -67.57 139.19 56.9 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.263 0.554 . . . . 3.46 111.357 -179.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.591 ' HB2' ' HA ' ' A' ' 48' ' ' SER . 14.1 m -136.32 146.49 46.64 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.836 -0.801 . . . . 1.71 108.836 176.144 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -111.47 132.84 54.19 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.12 0.486 . . . . 1.15 110.774 -173.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.469 ' HB2' ' CB ' ' A' ' 47' ' ' LYS . 4.2 t70 -117.48 108.72 15.86 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.319 -0.993 . . . . 1.35 108.319 175.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.488 ' HA ' ' O ' ' A' ' 43' ' ' GLU . . . -111.15 124.91 53.13 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.14 0.495 . . . . 0.51 112.08 -171.462 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.506 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 58.6 t -90.02 116.74 31.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.641 -0.709 . . . . 0.55 109.421 174.365 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.66 HG12 ' HA ' ' A' ' 94' ' ' CYS . 2.5 pt -97.42 145.29 9.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 121.146 0.498 . . . . 1.18 110.77 -176.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.693 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 89.1 t -131.63 97.66 3.0 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 115.502 -0.772 . . . . 0.58 108.939 174.509 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.479 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 41.9 t -144.12 138.64 28.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.321 0.582 . . . . 0.84 112.1 -174.207 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.573 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 3.8 m120 -67.66 -19.17 65.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.323 -0.853 . . . . 1.67 111.391 174.368 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -61.69 -22.35 65.25 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.364 0.602 . . . . 1.81 110.581 -178.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.647 ' CD2' ' HD2' ' A' ' 72' ' ' ARG . 13.5 m-85 -102.44 -5.91 23.55 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.943 -0.571 . . . . 3.19 112.156 -174.518 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.573 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -80.92 -10.09 59.76 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.946 0.403 . . . . 2.14 110.69 -176.85 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -75.79 -9.3 58.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.82 -0.627 . . . . 2.03 109.817 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.449 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 2.7 mmmp? 68.55 18.6 8.88 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.169 -0.923 . . . . 3.31 111.942 175.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.794 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 31.1 mmmt -69.5 89.79 0.52 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.347 -0.388 . . . . 1.99 109.995 174.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -63.77 -59.67 4.26 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.742 0.306 . . . . 2.33 110.476 -175.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.426 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.19 -31.18 71.4 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.188 -0.46 . . . . 1.09 111.31 -177.327 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.794 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 27.0 t70 -73.91 -43.95 56.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.498 -0.319 . . . . 2.08 110.788 -175.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.647 ' HD2' ' CD2' ' A' ' 64' ' ' PHE . 26.8 ptt180 -69.14 -31.93 70.94 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.297 -0.561 . . . . 2.93 109.76 177.668 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -65.03 -49.72 69.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.152 -0.477 . . . . 1.21 110.515 177.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.631 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 3.0 ptm180 -63.59 -40.93 98.21 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.52 -0.309 . . . . 1.67 110.767 -179.243 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.26 -50.34 68.33 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.631 0.253 . . . . 1.48 110.935 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 72' ' ' ARG . 49.2 t -56.58 -47.03 82.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.304 -0.407 . . . . 0.82 110.94 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -66.56 -29.93 70.12 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 121.097 -0.241 . . . . 1.14 111.619 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 85.4 m -67.61 -43.91 79.31 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.865 0.364 . . . . 0.69 111.307 -179.094 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.3 mp -81.29 -42.9 20.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 CA-C-O 121.331 0.586 . . . . 0.77 110.623 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.755 ' HA ' ' CB ' ' A' ' 83' ' ' GLU . 10.9 mp -73.27 -3.64 28.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.148 -0.478 . . . . 0.78 111.129 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 45.6 tptt -51.8 -63.29 1.18 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.534 -0.543 . . . . 1.93 109.534 169.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -75.16 -33.28 61.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.958 0.409 . . . . 2.91 110.346 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.755 ' CB ' ' HA ' ' A' ' 80' ' ' LEU . 1.9 tp10 -54.02 -56.23 19.93 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.751 0.786 . . . . 1.66 111.727 -176.178 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 57.5 mt -50.25 -30.95 12.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.243 -1.344 . . . . 0.58 112.882 177.374 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -54.76 -24.43 22.43 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.031 0.378 . . . . 0.92 111.608 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -102.6 -0.02 32.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.553 -0.294 . . . . 1.02 111.75 -176.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 8.3 mt -126.13 139.88 50.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.683 0.278 . . . . 0.77 110.383 -176.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 50.0 t60 -70.37 -42.19 72.11 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.804 -0.443 . . . . 1.85 109.804 175.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.418 ' O ' ' HB3' ' A' ' 54' ' ' SER . . . -157.54 111.6 2.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.159 -0.473 . . . . 0.78 110.629 177.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -103.11 121.87 43.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.387 -0.369 . . . . 0.63 110.504 176.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.3 m -111.33 147.32 35.37 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.754 -0.657 . . . . 1.27 109.494 177.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -135.82 142.17 44.81 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.013 0.435 . . . . 0.64 111.433 -178.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -109.49 112.98 25.39 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.291 -0.633 . . . . 2.23 109.291 173.196 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.66 ' HA ' HG12 ' A' ' 59' ' ' ILE . 5.7 p -83.54 116.22 22.47 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.923 -0.581 . . . . 1.38 111.224 -175.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -143.62 166.95 23.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.29 0.566 . . . . 1.98 111.372 176.065 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.527 HG21 ' HB3' ' A' ' 65' ' ' GLU . 22.0 p -113.87 163.32 19.07 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 115.544 -0.753 . . . . 0.76 110.901 -179.19 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.95 -24.0 78.52 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.759 2.306 . . . . 0.72 111.899 177.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -66.44 -49.35 67.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.844 -0.616 . . . . 2.08 110.032 178.074 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.546 ' HA ' ' HD3' ' A' ' 102' ' ' LYS . 34.4 mt-10 -76.96 -30.44 56.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.071 -0.513 . . . . 2.69 110.682 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 52.0 t80 -66.88 -41.45 87.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.435 -0.348 . . . . 1.46 110.976 177.456 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -57.13 -38.14 73.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.027 0.442 . . . . 1.23 110.77 178.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.853 ' HA ' ' HE2' ' A' ' 106' ' ' LYS . 15.2 mtpp -58.07 -48.05 81.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.852 -0.613 . . . . 2.66 110.558 178.581 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 53.2 mt -66.89 -41.95 86.35 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.85 -0.614 . . . . 1.31 111.682 -175.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.48 ' HG3' ' N ' ' A' ' 105' ' ' SER . 7.0 pttp -83.09 -40.56 19.68 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.418 0.525 . . . . 1.84 112.418 -172.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.522 ' HB2' ' HD3' ' A' ' 106' ' ' LYS . 17.5 m -83.04 -50.17 8.8 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 111.95 0.352 . . . . 2.05 111.95 -172.07 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.853 ' HE2' ' HA ' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -117.76 -53.17 2.41 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.427 0.528 . . . . 4.02 112.427 -175.193 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 136.65 -41.94 1.36 Allowed Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.97 -0.633 . . . . 3.92 111.581 -176.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 51.3 m . . . . . 0 C--O 1.246 0.886 0 CA-C-O 118.58 -0.724 . . . . 4.98 110.211 178.767 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.1 ppp? . . . . . 0 N--CA 1.479 1.004 0 N-CA-C 110.171 -0.307 . . . . 36.14 110.171 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -112.6 -168.6 17.57 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.491 -0.861 . . . . 33.7 112.351 -178.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 42.3 m -84.86 -8.07 58.93 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.034 0.445 . . . . 32.35 110.525 178.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 24.4 m -77.85 114.04 16.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.979 -0.555 . . . . 30.38 110.198 177.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -97.12 165.69 11.94 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.07 -0.514 . . . . 28.39 111.303 -177.32 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 42.5 m80 -92.35 161.95 14.46 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.641 -0.709 . . . . 28.54 109.681 178.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 -121.57 97.84 5.69 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.012 0.434 . . . . 26.47 110.817 -177.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -86.86 109.75 19.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.061 -0.518 . . . . 24.34 110.25 175.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 58.3 m-70 -92.34 157.7 16.49 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.287 -0.415 . . . . 23.8 110.569 -177.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.7 t60 63.56 72.74 0.46 Allowed 'General case' 0 N--CA 1.464 0.225 0 O-C-N 123.716 0.635 . . . . 20.9 109.888 -175.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 35.8 t -154.11 111.26 3.4 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.666 -0.697 . . . . 19.89 109.586 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.7 p -94.3 89.0 5.75 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.975 0.417 . . . . 17.26 111.246 -176.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.611 ' HA2' ' HB3' ' A' ' 23' ' ' MET . . . 123.23 62.85 0.2 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.628 -0.796 . . . . 16.67 113.013 175.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 30.2 mtm180 -92.15 -44.07 9.01 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.511 -0.552 . . . . 19.13 109.511 177.162 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.416 ' HB2' ' CD1' ' A' ' 18' ' ' TYR . 1.4 pm0 -88.98 36.24 0.81 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.965 -0.562 . . . . 14.57 110.251 174.634 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.562 ' HA ' ' HA ' ' A' ' 22' ' ' HIS . 9.3 p30 -62.77 -8.96 7.75 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.728 -0.669 . . . . 15.4 111.59 -177.335 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.402 ' N ' HD22 ' A' ' 17' ' ' LEU . 2.9 mm? -71.3 -23.18 61.9 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.98 0.419 . . . . 16.35 110.242 178.31 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.416 ' CD1' ' HB2' ' A' ' 15' ' ' GLU . 5.6 m-85 -78.14 132.26 37.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.767 -0.651 . . . . 15.41 109.748 177.457 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.4 p90 -72.91 -28.15 62.3 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.101 0.477 . . . . 11.39 109.893 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.36 3.46 55.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.916 -0.584 . . . . 10.77 110.842 -179.563 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -151.74 47.9 0.56 Allowed Glycine 0 N--CA 1.444 -0.77 0 C-N-CA 120.748 -0.739 . . . . 6.73 111.836 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.562 ' HA ' ' HA ' ' A' ' 16' ' ' ASN . 6.0 t60 -69.57 -24.33 63.68 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.835 -0.802 . . . . 6.08 108.835 178.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.611 ' HB3' ' HA2' ' A' ' 13' ' ' GLY . 6.8 tpt 71.9 71.67 0.16 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-N 114.435 -1.257 . . . . 4.41 111.388 170.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.575 ' O ' HG23 ' A' ' 28' ' ' VAL . 21.3 t -76.48 135.65 39.36 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.39 -0.823 . . . . 1.71 109.591 173.614 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.0 tp -57.06 -38.65 61.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 O-C-N 123.242 0.339 . . . . 1.37 111.088 -176.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -61.68 -43.86 98.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.928 0.394 . . . . 1.75 110.279 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -71.27 -26.3 62.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.122 -0.49 . . . . 2.5 111.01 -177.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.575 HG23 ' O ' ' A' ' 24' ' ' CYS . 91.2 t -61.76 -53.86 42.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.367 -0.379 . . . . 1.04 110.19 176.201 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.482 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.8 mp -61.17 -43.76 97.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.784 -0.644 . . . . 0.79 110.228 178.424 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -52.67 -51.81 58.56 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 116.028 -0.533 . . . . 2.2 111.769 178.001 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -69.69 -30.93 68.7 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.283 0.563 . . . . 1.67 110.684 -177.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 31.1 tttm -68.57 -54.48 16.35 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.378 -0.828 . . . . 2.03 111.065 -176.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 3.9 pp -71.92 -27.04 62.55 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 120.757 -0.377 . . . . 0.57 111.048 176.768 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.466 ' N ' HD12 ' A' ' 33' ' ' LEU . 44.3 t -61.93 -44.04 97.6 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-O 120.805 0.336 . . . . 1.29 110.226 176.301 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.2 m -64.22 -27.37 69.01 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.327 -0.397 . . . . 0.78 110.965 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.86 -54.43 5.6 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.093 0.405 . . . . 0.64 112.093 -177.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.0 mt -97.07 -35.59 10.77 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.867 0.365 . . . . 0.94 111.725 -174.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.49 ' HD3' ' HA ' ' A' ' 38' ' ' LYS . 31.8 mmtt 58.15 87.29 0.14 Allowed Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.364 -0.835 . . . . 3.36 112.862 -177.631 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.817 ' HB3' HG12 ' A' ' 59' ' ' ILE . 73.7 Cg_endo -82.91 137.62 8.77 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 122.62 2.213 . . . . 0.63 111.34 171.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 33.4 p -77.54 -23.89 50.01 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.42 0.629 . . . . 0.73 109.695 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.623 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 83.9 t80 -136.3 124.05 22.5 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.123 -0.944 . . . . 0.76 109.176 172.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.419 HD12 ' O ' ' A' ' 58' ' ' VAL . 56.7 tp -134.9 113.86 11.97 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.432 -0.349 . . . . 1.55 110.337 -177.773 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -120.37 124.85 46.54 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.385 -0.371 . . . . 2.23 110.974 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 67.1 mt -86.4 122.16 29.97 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.172 0.511 . . . . 1.72 110.787 175.137 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 67.6 t -106.96 111.09 34.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.479 -0.782 . . . . 1.08 109.05 175.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -69.28 102.11 1.65 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.994 -0.548 . . . . 1.83 109.977 -177.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 36.2 mmtm -76.66 167.0 22.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.046 -0.525 . . . . 2.76 111.05 -177.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.3 p -63.05 130.21 43.68 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.935 -0.575 . . . . 3.2 110.386 176.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.7 p -62.2 -67.55 0.41 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.091 -0.504 . . . . 4.74 111.466 -178.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 68.31 -82.32 0.19 Allowed Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 121.031 -0.604 . . . . 3.16 112.51 179.574 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 10.8 p -94.74 -19.1 20.66 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.83 0.347 . . . . 4.36 111.002 -179.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 168.29 -176.09 42.82 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.81 -0.709 . . . . 2.26 111.996 179.292 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.446 ' O ' ' HB3' ' A' ' 88' ' ' HIS . 19.9 m -58.65 115.34 2.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.865 0.364 . . . . 3.46 111.299 -179.246 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.3 m -127.12 120.79 29.7 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.867 -0.606 . . . . 1.71 110.993 -176.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -111.43 138.69 47.61 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.091 -0.504 . . . . 1.15 110.384 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -116.54 123.02 46.38 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.24 -0.652 . . . . 1.35 109.24 176.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.98 115.74 30.74 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.863 0.363 . . . . 0.51 110.899 -176.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.789 HG22 ' HE2' ' A' ' 93' ' ' LYS . 38.3 t -81.07 110.95 17.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 108.621 -0.881 . . . . 0.55 108.621 173.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.817 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -111.53 107.7 23.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 CA-C-O 121.679 0.752 . . . . 1.18 110.485 -174.011 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.623 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 58.0 t -104.58 106.64 20.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 CA-C-N 114.94 -1.027 . . . . 0.58 108.464 174.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.589 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 32.7 t -142.84 147.43 35.41 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.755 0.65 . . . . 0.84 112.755 -170.243 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.473 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 5.5 t30 -64.09 -22.19 66.83 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 114.988 -1.006 . . . . 1.67 110.829 173.258 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -63.35 -35.62 81.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.188 0.518 . . . . 1.81 110.417 -177.328 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.415 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 27.2 t80 -100.49 12.04 38.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.318 0.58 . . . . 3.19 110.118 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.473 ' HB3' ' O ' ' A' ' 62' ' ' ASN . 2.2 tp10 -81.31 -28.55 34.55 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 108.087 -1.079 . . . . 2.14 108.087 176.232 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.599 ' OD2' ' HG3' ' A' ' 68' ' ' LYS . 21.0 t70 -57.32 -41.13 79.33 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 108.293 -1.003 . . . . 2.03 108.293 166.203 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.0 ttpm? 75.59 25.02 1.25 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 114.476 -1.238 . . . . 3.31 113.161 161.12 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.599 ' HG3' ' OD2' ' A' ' 66' ' ' ASP . 36.7 mtmm -74.76 122.53 23.44 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 121.97 -0.456 . . . . 1.99 109.959 169.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.5 pp -74.0 -32.18 63.28 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.772 -0.371 . . . . 2.33 110.953 -175.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.504 HD13 ' HB3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -67.72 -30.81 70.4 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.038 0.447 . . . . 1.09 110.417 177.32 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.469 ' HB2' ' HE2' ' A' ' 68' ' ' LYS . 36.0 t70 -72.62 -36.91 68.16 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.155 0.502 . . . . 2.08 109.658 179.49 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.415 ' HB2' ' CE1' ' A' ' 64' ' ' PHE . 48.3 ttt-85 -57.77 -47.25 83.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.496 -0.775 . . . . 2.93 109.563 172.309 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -57.22 -54.46 46.5 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.143 -0.935 . . . . 1.21 111.28 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.428 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 13.2 ptm180 -70.7 -46.42 63.15 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.285 0.476 . . . . 1.67 112.285 -172.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 75' ' ' LEU . 27.3 mt -63.08 -45.97 89.63 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 111.759 0.281 . . . . 1.48 111.759 -176.738 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.536 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 58.7 t -58.05 -48.25 84.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.57 -0.286 . . . . 0.82 110.487 179.002 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -66.58 -31.7 72.57 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.687 -0.405 . . . . 1.14 111.564 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 99.2 m -61.71 -61.41 2.53 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.655 0.242 . . . . 0.69 111.655 -178.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.5 mp -75.95 -43.8 38.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-O 121.071 0.463 . . . . 0.77 110.833 -176.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.802 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.4 mp -77.65 -7.55 56.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.903 -0.59 . . . . 0.78 112.338 -171.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -50.13 -62.55 1.51 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.277 0.56 . . . . 1.93 109.9 171.361 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -75.15 -33.52 61.53 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.448 -0.796 . . . . 2.91 110.708 177.446 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.802 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.3 tp10 -56.29 -53.53 56.21 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.477 0.656 . . . . 1.66 112.026 -176.261 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.672 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 66.3 mt -50.72 -30.44 13.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.711 -1.131 . . . . 0.58 112.505 179.662 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -53.5 -27.36 25.07 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.046 0.451 . . . . 0.92 111.038 -178.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -87.0 -6.78 58.64 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.804 -0.634 . . . . 1.02 111.701 -175.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.476 HD12 ' HB2' ' A' ' 90' ' ' PHE . 3.2 mt -125.52 160.36 31.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 109.969 -0.382 . . . . 0.77 109.969 -176.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.446 ' HB3' ' O ' ' A' ' 53' ' ' THR . 10.5 t60 -79.36 -54.82 5.56 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.421 -0.585 . . . . 1.85 109.421 174.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -145.26 115.59 7.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.828 -0.624 . . . . 0.78 110.176 177.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' PHE . . . . . 0.476 ' HB2' HD12 ' A' ' 87' ' ' ILE . 86.2 t80 -108.4 129.19 55.26 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.161 0.505 . . . . 0.63 110.605 177.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 38.2 t -115.02 146.76 40.93 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.267 -0.879 . . . . 1.27 109.25 177.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -129.3 130.69 46.48 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.929 0.395 . . . . 0.64 110.417 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.789 ' HE2' HG22 ' A' ' 58' ' ' VAL . 2.3 ttmm -113.7 109.01 17.9 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.864 -0.791 . . . . 2.23 108.864 176.613 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.514 ' HA ' HG23 ' A' ' 59' ' ' ILE . 13.2 p -92.16 140.9 29.17 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.934 0.397 . . . . 1.38 111.358 -172.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.617 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 8.7 t60 -153.65 154.43 34.16 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.939 -0.573 . . . . 1.98 109.712 177.414 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.407 ' CG2' ' HA ' ' A' ' 65' ' ' GLU . 1.3 p -96.6 148.79 34.97 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 121.042 0.449 . . . . 0.76 112.093 -177.296 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -67.87 -35.34 21.31 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 123.255 2.637 . . . . 0.72 113.075 -176.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' A' ' 98' ' ' LEU . 4.4 mm? -59.4 -48.22 82.46 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.112 0.482 . . . . 2.08 110.225 179.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -66.24 -33.78 76.52 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.623 -0.717 . . . . 2.69 111.012 177.375 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 49.7 t80 -69.83 -33.99 73.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.469 -0.332 . . . . 1.46 111.4 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -58.08 -35.15 70.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.94 0.4 . . . . 1.23 111.087 -178.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.704 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -74.91 -29.35 60.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.907 0.384 . . . . 2.66 110.378 178.528 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.772 ' HA ' ' HA2' ' A' ' 107' ' ' GLY . 89.7 mt -67.84 -47.09 69.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.941 -0.572 . . . . 1.31 110.67 179.19 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.88 -15.78 61.59 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.205 -0.452 . . . . 1.84 111.147 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 28.4 t -80.95 -39.62 25.81 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.766 -0.457 . . . . 2.05 109.766 176.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.28 -41.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.821 -0.627 . . . . 4.02 110.74 179.103 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.772 ' HA2' ' HA ' ' A' ' 103' ' ' LEU . . . 117.18 27.17 2.75 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.419 -0.809 . . . . 3.92 111.684 -179.153 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.5 t . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.27 -0.871 . . . . 4.98 109.455 -178.311 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.1 ptt? . . . . . 0 N--CA 1.479 0.988 0 N-CA-C 109.919 -0.4 . . . . 36.14 109.919 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 110.87 25.49 5.1 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.362 -0.923 . . . . 33.7 112.532 177.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.3 m -101.6 -4.28 26.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.23 0.538 . . . . 32.35 110.01 178.108 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.2 m -110.32 147.16 34.44 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.4 -0.818 . . . . 30.38 109.974 -177.294 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.8 p80 -93.05 87.14 5.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.517 0.675 . . . . 28.39 111.442 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -109.6 13.31 23.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.877 -0.602 . . . . 28.54 110.275 175.198 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -162.45 143.58 10.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.168 -0.469 . . . . 26.47 110.343 -178.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 50.6 t-80 -92.95 147.62 22.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.143 -0.48 . . . . 24.34 109.756 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 40.2 m-70 -82.78 -174.42 5.23 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.927 0.394 . . . . 23.8 111.014 178.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.9 m-70 -97.04 129.43 44.48 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.081 -0.509 . . . . 20.9 111.523 -176.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.41 ' HB2' ' H ' ' A' ' 12' ' ' SER . 3.5 p -88.22 -146.53 0.15 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.564 -0.744 . . . . 19.89 110.194 175.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.41 ' H ' ' HB2' ' A' ' 11' ' ' SER . 11.6 t -61.53 129.2 40.0 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.854 -0.424 . . . . 17.26 109.854 177.527 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 128.85 -0.51 6.2 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 121.16 -0.543 . . . . 16.67 111.75 -176.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.1 ptt180 -93.89 -26.6 16.81 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.365 0.603 . . . . 19.13 109.843 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.416 ' H ' ' CD ' ' A' ' 15' ' ' GLU . 1.2 pm0 -87.65 16.87 5.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.412 -0.813 . . . . 14.57 111.198 -176.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -69.15 -9.06 50.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.063 0.459 . . . . 15.4 110.407 178.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 87.9 mt -68.94 -20.19 64.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.858 -0.61 . . . . 16.35 110.47 177.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 -104.73 142.92 33.85 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.982 -0.554 . . . . 15.41 109.748 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 48.2 p90 -59.56 -39.05 82.78 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.703 0.287 . . . . 11.39 111.441 -176.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.411 ' H ' ' HG3' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -89.0 8.08 31.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.85 0.357 . . . . 10.77 111.273 -179.607 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -94.59 -9.39 58.87 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.78 -0.724 . . . . 6.73 112.19 -177.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -148.58 113.53 5.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.22 0.534 . . . . 6.08 110.112 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 75.8 mtm -130.46 145.22 51.8 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.19 -0.459 . . . . 4.41 110.06 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 32.3 m -65.83 146.11 55.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.033 -0.531 . . . . 1.71 110.74 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.3 tp -57.2 -34.04 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-O 121.178 0.513 . . . . 1.37 110.925 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -65.52 -38.89 91.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.104 -0.498 . . . . 1.75 110.922 178.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.718 ' HA ' ' HE3' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -68.4 -46.57 69.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.093 -0.503 . . . . 2.5 111.193 -175.615 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.533 ' O ' ' HG2' ' A' ' 32' ' ' LYS . 5.3 p -64.87 -46.04 93.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 C-N-CA 120.833 -0.347 . . . . 1.04 111.163 -177.445 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.47 HD12 HG13 ' A' ' 28' ' ' VAL . 1.7 mp -60.71 -47.62 92.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-O 121.033 0.444 . . . . 0.79 110.721 178.577 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.64 -42.02 91.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.326 -0.397 . . . . 2.2 110.77 -178.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -68.04 -35.4 78.2 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.167 -0.47 . . . . 1.67 111.423 -175.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 28' ' ' VAL . 74.1 mmtt -65.06 -55.61 17.84 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.935 0.398 . . . . 2.03 111.067 -178.714 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.497 HD12 ' N ' ' A' ' 34' ' ' SER . 3.3 pp -71.81 -28.9 63.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.126 -0.488 . . . . 0.57 112.135 -174.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.497 ' N ' HD12 ' A' ' 33' ' ' LEU . 69.7 m -69.23 -43.05 74.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.769 0.319 . . . . 1.29 110.97 179.56 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.7 m -71.3 -27.45 63.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.1 0.476 . . . . 0.78 111.076 -178.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.65 -54.94 4.0 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.032 0.382 . . . . 0.64 112.032 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.1 mt -81.85 -32.04 31.33 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.848 0.314 . . . . 0.94 111.848 -173.208 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm 65.16 74.77 0.38 Allowed Pre-proline 0 N--CA 1.468 0.456 0 O-C-N 123.595 0.559 . . . . 3.36 110.99 -175.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.6 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 63.0 Cg_endo -88.66 134.76 2.83 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 122.289 1.993 . . . . 0.63 112.374 176.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 30.4 p -68.86 -30.56 69.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.276 0.56 . . . . 0.73 109.64 175.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.677 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 86.3 t80 -141.91 134.27 27.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.325 -0.852 . . . . 0.76 109.262 174.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.414 HD22 ' HA ' ' A' ' 42' ' ' LEU . 1.4 tm? -142.24 126.16 17.19 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.547 -0.538 . . . . 1.55 109.547 -178.69 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -137.48 127.79 26.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.889 0.375 . . . . 2.23 110.934 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.412 HD22 ' N ' ' A' ' 44' ' ' LEU . 2.5 mm? -90.61 115.76 27.98 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.368 -0.604 . . . . 1.72 109.368 177.289 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 52.5 t -109.08 118.25 56.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.901 0.382 . . . . 1.08 110.769 -178.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -91.19 123.64 34.79 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.108 -0.701 . . . . 1.83 109.108 173.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 60.6 tttp -136.38 89.46 2.47 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.791 0.329 . . . . 2.76 110.857 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 44.6 m 54.45 62.46 2.55 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.454 -0.794 . . . . 3.2 112.164 174.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 3.5 p -75.63 111.22 10.72 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.132 -0.485 . . . . 4.74 109.905 176.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -78.42 -45.97 9.34 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.962 -0.637 . . . . 3.16 113.188 -174.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 45.8 m -108.18 102.32 11.48 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.786 0.327 . . . . 4.36 111.4 -176.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 70.13 -94.6 0.46 Allowed Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.941 -0.572 . . . . 2.26 112.342 177.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.8 t -152.66 135.83 15.72 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.219 0.533 . . . . 3.46 110.488 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 62.3 m -146.52 119.62 8.84 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.315 -0.857 . . . . 1.71 109.109 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -111.39 137.6 48.96 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.597 -0.274 . . . . 1.15 110.82 -176.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -102.18 110.23 22.13 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.754 -1.202 . . . . 1.35 107.754 168.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.77 117.53 34.25 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 120.899 0.38 . . . . 0.51 111.268 -171.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.7 t -73.39 111.27 7.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 109.026 -0.731 . . . . 0.55 109.026 176.285 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -106.87 107.81 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 CA-C-O 121.774 0.797 . . . . 1.18 109.571 -178.313 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.677 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 58.7 t -108.21 103.97 16.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.108 -0.951 . . . . 0.58 108.971 177.087 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.6 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 29.0 t -145.26 153.27 41.13 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.986 0.422 . . . . 0.84 111.291 -175.002 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.743 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 22.9 m120 -67.44 -19.21 65.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.486 -0.779 . . . . 1.67 110.477 175.083 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -63.65 -18.97 64.5 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.236 0.541 . . . . 1.81 110.384 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.612 ' HD2' HG23 ' A' ' 96' ' ' THR . 62.9 t80 -93.46 -19.8 20.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 3.19 111.561 -178.432 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.743 ' HG2' ' O ' ' A' ' 62' ' ' ASN . 11.9 pt-20 -71.23 -20.06 62.29 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.627 -0.429 . . . . 2.14 110.474 -176.318 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.633 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . 17.2 m-20 -69.15 -20.48 64.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.029 -0.532 . . . . 2.03 110.581 175.473 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.402 ' HD3' ' HA ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER 64.11 19.74 11.89 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.453 -0.794 . . . . 3.31 110.777 177.222 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.633 ' HG2' ' HB3' ' A' ' 66' ' ' ASP . 31.3 mmmt -79.54 102.63 8.95 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.907 -0.588 . . . . 1.99 110.323 -178.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.411 HD12 ' N ' ' A' ' 70' ' ' LEU . 3.7 pp -67.55 -44.22 78.8 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.324 -0.398 . . . . 2.33 110.767 -177.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.431 ' CD1' ' H ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.73 -31.24 71.04 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.49 -0.323 . . . . 1.09 111.254 -178.972 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.703 ' HA ' ' HD2' ' A' ' 74' ' ' ARG . 4.8 m-20 -73.55 -44.77 56.68 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 121.094 -0.242 . . . . 2.08 111.345 -178.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 18.3 ptt180 -67.89 -31.93 72.07 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.909 -0.716 . . . . 2.93 109.82 176.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -64.03 -50.97 66.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.071 -0.513 . . . . 1.21 110.521 176.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.703 ' HD2' ' HA ' ' A' ' 71' ' ' ASP . 5.0 ptm180 -63.57 -39.55 94.68 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.399 -0.364 . . . . 1.67 110.836 -177.255 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -66.48 -51.84 52.48 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.723 0.297 . . . . 1.48 111.046 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.705 HG13 HD22 ' A' ' 80' ' ' LEU . 45.6 t -57.74 -45.69 86.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.065 -0.516 . . . . 0.82 110.978 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.555 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 12.7 m120 -62.73 -42.01 99.45 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.475 -0.49 . . . . 1.14 111.262 -178.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.467 ' HB ' HD12 ' A' ' 79' ' ' ILE . 89.3 m -58.76 -54.67 44.44 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.113 0.412 . . . . 0.69 112.113 -175.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.467 HD12 ' HB ' ' A' ' 78' ' ' THR . 4.3 mp -88.01 -48.51 15.04 Favored 'Isoleucine or valine' 0 C--O 1.242 0.663 0 CA-C-O 121.643 0.735 . . . . 0.77 111.016 -175.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.79 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 7.7 mp -73.31 -4.37 32.82 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.654 -0.703 . . . . 0.78 111.668 -173.601 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.555 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 17.6 tppt? -55.72 -60.0 4.07 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.358 -0.608 . . . . 1.93 109.358 168.603 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.453 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 6.9 mm-40 -67.72 -32.94 73.91 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.65 -0.705 . . . . 2.91 110.261 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.642 ' CB ' ' HA ' ' A' ' 80' ' ' LEU . 2.6 tp10 -54.59 -55.35 30.35 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.815 -0.63 . . . . 1.66 111.054 176.187 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.79 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 56.3 mt -51.03 -30.58 15.88 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.273 -0.876 . . . . 0.58 112.46 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.453 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 23.1 mm-40 -54.41 -25.52 25.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.64 0.257 . . . . 0.92 111.436 -176.471 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -106.63 8.28 31.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.716 0.293 . . . . 1.02 111.326 -177.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 11.2 mt -129.35 155.81 41.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 109.635 -0.506 . . . . 0.77 109.635 -178.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -86.9 -61.11 1.8 Allowed 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.414 -0.514 . . . . 1.85 109.778 175.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -137.85 95.15 2.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.056 0.455 . . . . 0.78 110.99 178.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -84.68 119.63 25.47 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.018 -0.537 . . . . 0.63 110.204 176.632 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 38.0 m -112.42 157.13 21.43 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.556 -0.535 . . . . 1.27 109.556 177.287 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -134.97 137.78 43.38 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.96 0.409 . . . . 0.64 110.655 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -103.12 109.0 20.41 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.338 -0.986 . . . . 2.23 108.338 176.175 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.7 m -88.08 127.84 35.41 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 111.837 0.31 . . . . 1.38 111.837 -169.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.617 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 73.0 m-70 -148.42 160.95 42.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.108 0.48 . . . . 1.98 110.668 174.433 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.612 HG23 ' HD2' ' A' ' 64' ' ' PHE . 22.6 p -108.44 159.42 30.87 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.771 -0.65 . . . . 0.76 110.697 176.469 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -59.26 -26.35 81.5 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.594 2.196 . . . . 0.72 111.834 176.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -62.9 -49.78 73.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.012 -0.54 . . . . 2.08 109.961 176.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.481 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 30.5 mt-10 -60.4 -47.71 84.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.873 -0.603 . . . . 2.69 110.313 176.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.578 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 51.4 t80 -60.43 -39.16 86.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.617 -0.72 . . . . 1.46 111.087 -177.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.527 ' HA ' ' HE2' ' A' ' 104' ' ' LYS . 18.8 t70 -60.78 -37.68 82.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.954 0.407 . . . . 1.23 110.772 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.538 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.3 OUTLIER -71.92 -32.35 67.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.138 -0.483 . . . . 2.66 110.362 178.6 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 85.7 mt -64.43 -41.6 96.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.071 -0.513 . . . . 1.31 110.83 177.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.578 ' HG3' ' O ' ' A' ' 100' ' ' TYR . 12.2 mtmt -63.98 -43.13 96.64 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.501 0.667 . . . . 1.84 109.704 176.749 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 48.4 m -69.54 -71.3 0.23 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.81 -1.086 . . . . 2.05 111.722 -173.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.445 ' HG3' ' O ' ' A' ' 102' ' ' LYS . 5.8 pttt -99.56 -36.55 9.49 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.739 0.305 . . . . 4.02 111.348 -176.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 109.02 12.92 19.35 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.68 -0.771 . . . . 3.92 112.011 -178.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.458 ' OXT' ' HB3' ' A' ' 102' ' ' LYS . 34.1 m . . . . . 0 C--O 1.249 1.075 0 N-CA-C 108.969 -0.752 . . . . 4.98 108.969 179.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.1 mtm . . . . . 0 N--CA 1.48 1.05 0 N-CA-C 109.389 -0.597 . . . . 36.14 109.389 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -101.94 110.58 3.85 Favored Glycine 0 N--CA 1.441 -0.971 0 N-CA-C 110.573 -1.011 . . . . 33.7 110.573 171.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 56.1 m -52.59 110.53 0.52 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.984 0.421 . . . . 32.35 110.847 -177.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.8 m -78.93 116.04 19.0 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.887 -0.597 . . . . 30.38 110.344 -177.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -106.48 174.05 6.06 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.823 -0.626 . . . . 28.39 110.459 -177.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 14.3 m170 -100.96 144.95 29.28 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 110.223 -0.288 . . . . 28.54 110.223 -174.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.0 m170 -95.39 151.9 18.87 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.557 -0.534 . . . . 26.47 109.557 175.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 27.6 t60 -71.94 124.97 26.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.002 0.43 . . . . 24.34 110.779 -173.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -111.63 172.22 7.02 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.914 -0.584 . . . . 23.8 109.662 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 43.5 p-80 -90.7 119.8 31.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.271 0.557 . . . . 20.9 110.16 177.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 25.1 m -92.36 161.37 14.7 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.756 -0.656 . . . . 19.89 110.022 178.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.7 m -87.1 9.09 20.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.484 0.659 . . . . 17.26 111.146 -176.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -85.62 12.23 59.68 Favored Glycine 0 C--O 1.224 -0.495 0 CA-C-N 115.366 -0.834 . . . . 16.67 111.335 177.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.495 ' HG3' ' HG2' ' A' ' 15' ' ' GLU . 4.4 ptm85 -72.77 -36.19 67.59 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 122.943 0.497 . . . . 19.13 111.506 -179.304 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.51 ' HB2' ' CE2' ' A' ' 18' ' ' TYR . 5.9 pt-20 -119.48 61.55 0.82 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.78 0.8 . . . . 14.57 111.183 -174.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -88.92 3.8 50.16 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.783 -1.099 . . . . 15.4 110.338 177.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.7 mt -75.11 -32.24 61.34 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.741 -0.663 . . . . 16.35 111.872 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.66 ' HB3' ' HA3' ' A' ' 21' ' ' GLY . 8.3 m-85 -80.94 88.27 5.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.72 0.295 . . . . 15.41 110.469 -176.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -83.51 -12.99 55.57 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.978 0.418 . . . . 11.39 110.774 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.15 12.78 5.14 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.551 0.691 . . . . 10.77 109.591 174.783 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.66 ' HA3' ' HB3' ' A' ' 18' ' ' TYR . . . -93.59 -46.77 3.13 Favored Glycine 0 N--CA 1.449 -0.499 0 CA-C-N 115.419 -0.809 . . . . 6.73 113.942 -171.156 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -129.47 17.86 5.88 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 117.37 0.585 . . . . 6.08 111.531 -174.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 66.4 mtm -117.9 157.15 27.2 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.742 -0.466 . . . . 4.41 109.742 177.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 84.5 m -60.63 108.13 0.79 Allowed 'General case' 0 C--N 1.329 -0.31 0 O-C-N 123.216 0.322 . . . . 1.71 110.884 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 10.1 tp -59.48 -30.06 43.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.931 -0.577 . . . . 1.37 110.948 -178.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -60.31 -43.41 96.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.198 -0.455 . . . . 1.75 110.437 177.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.543 ' HE3' ' HB2' ' A' ' 31' ' ' ASP . 38.8 tptt -67.5 -36.92 82.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.956 -0.565 . . . . 2.5 110.843 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 61.3 t -57.91 -52.24 60.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.061 0.457 . . . . 1.04 110.589 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.475 HG13 ' HG3' ' A' ' 83' ' ' GLU . 1.8 mp -64.35 -47.34 90.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.808 -0.633 . . . . 0.79 110.542 178.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -54.81 -52.05 63.9 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 116.218 -0.446 . . . . 2.2 110.892 -179.01 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.543 ' HB2' ' HE3' ' A' ' 27' ' ' LYS . 10.6 t70 -66.07 -31.09 71.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.245 -0.434 . . . . 1.67 110.971 -174.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 52.3 tptt -70.15 -55.63 8.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.517 -0.31 . . . . 2.03 111.258 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.511 HD12 ' N ' ' A' ' 34' ' ' SER . 3.9 pp -71.47 -26.32 62.66 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.894 -0.322 . . . . 0.57 111.168 -178.519 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.511 ' N ' HD12 ' A' ' 33' ' ' LEU . 9.5 t -66.77 -42.24 86.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.94 0.4 . . . . 1.29 110.132 178.225 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 26.3 m -71.59 -27.07 62.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.12 0.486 . . . . 0.78 111.027 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.79 -52.2 7.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.121 -0.49 . . . . 0.64 111.615 -178.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.2 mt -83.65 -42.09 17.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.504 -0.316 . . . . 0.94 111.23 -176.189 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 56.92 83.94 0.22 Allowed Pre-proline 0 N--CA 1.464 0.227 0 CA-C-O 121.694 0.759 . . . . 3.36 111.436 -175.027 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.618 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 74.2 Cg_endo -92.24 151.47 3.11 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 123.271 2.647 . . . . 0.63 112.991 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.7 p -76.95 -27.24 54.75 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.419 0.628 . . . . 0.73 109.958 175.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.776 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 88.6 t80 -141.73 132.52 25.74 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.336 -0.847 . . . . 0.76 109.082 173.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.55 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 60.0 tp -142.38 121.42 12.89 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 110.317 -0.253 . . . . 1.55 110.317 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -124.4 115.83 21.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.065 0.46 . . . . 2.23 110.78 178.2 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -85.94 115.5 23.6 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.135 -0.691 . . . . 1.72 109.135 174.047 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.593 HG12 ' HG3' ' A' ' 47' ' ' LYS . 19.8 t -106.13 113.56 43.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 120.913 0.387 . . . . 1.08 110.711 -177.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -72.66 106.08 4.53 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.937 -0.574 . . . . 1.83 110.042 175.279 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.593 ' HG3' HG12 ' A' ' 45' ' ' VAL . 56.4 mtmt -133.05 98.12 4.19 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.816 -0.629 . . . . 2.76 109.706 177.364 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 34.0 t -64.51 110.71 2.4 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.303 0.573 . . . . 3.2 110.541 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 22.9 t -79.21 -11.18 59.96 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.47 -0.787 . . . . 4.74 110.182 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 156.34 -58.25 0.37 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 121.033 -0.603 . . . . 3.16 112.53 179.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 6.4 p -71.46 -32.32 68.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.87 0.367 . . . . 4.36 111.575 -177.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 114.85 -44.52 1.47 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.827 -0.701 . . . . 2.26 111.734 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.9 p -82.45 64.2 6.98 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.547 0.689 . . . . 3.46 110.903 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.426 ' HA ' ' O ' ' A' ' 89' ' ' ALA . 25.0 p -136.44 117.3 14.14 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.422 -0.808 . . . . 1.71 110.384 -179.417 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -124.96 137.69 54.25 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.176 -0.466 . . . . 1.15 110.442 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -114.68 122.04 45.23 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.831 -0.622 . . . . 1.35 109.519 178.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -107.11 115.99 31.14 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.911 0.386 . . . . 0.51 111.861 -174.169 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.2 t -83.25 111.76 19.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.19 -0.67 . . . . 0.55 109.19 173.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -111.97 115.09 48.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.646 0.736 . . . . 1.18 110.594 -174.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.776 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 74.7 t -114.49 106.83 21.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.013 -0.994 . . . . 0.58 109.411 176.635 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.618 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 42.5 t -146.7 153.01 39.76 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.87 0.692 . . . . 0.84 112.87 -173.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.46 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 80.4 m-20 -67.31 -22.0 65.64 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.109 -0.95 . . . . 1.67 110.518 172.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -65.57 -24.04 66.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.293 0.568 . . . . 1.81 110.13 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.445 ' CE1' ' HD3' ' A' ' 72' ' ' ARG . 71.0 t80 -103.06 -2.93 26.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.683 -0.69 . . . . 3.19 110.449 178.706 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.477 ' HA ' HG21 ' A' ' 96' ' ' THR . 0.9 OUTLIER -72.49 -33.18 66.77 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.584 -0.525 . . . . 2.14 109.584 -175.157 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.653 ' OD2' ' HD3' ' A' ' 68' ' ' LYS . 3.1 t70 -63.6 -14.41 51.29 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.716 -0.476 . . . . 2.03 109.716 176.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 30.6 mtmm 63.25 50.08 3.09 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.159 -0.928 . . . . 3.31 111.458 174.024 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.653 ' HD3' ' OD2' ' A' ' 66' ' ' ASP . 30.5 mmmt -89.37 96.09 10.56 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.091 -0.959 . . . . 1.99 110.527 179.256 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 46.9 tp -55.69 -64.31 0.89 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.018 -0.537 . . . . 2.33 111.741 -178.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.419 ' CD1' ' H ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -65.92 -31.01 71.69 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.211 -0.449 . . . . 1.09 111.46 -175.143 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.579 ' HB2' ' HB3' ' A' ' 68' ' ' LYS . 23.3 m-20 -73.59 -36.42 65.54 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.844 0.313 . . . . 2.08 111.844 -176.464 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.445 ' HD3' ' CE1' ' A' ' 64' ' ' PHE . 25.0 ptt85 -69.9 -32.93 71.52 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 119.891 -0.724 . . . . 2.93 109.393 175.62 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -64.73 -49.36 71.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.693 -0.685 . . . . 1.21 110.231 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.525 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 4.2 ptm180 -69.57 -40.51 76.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.864 -0.607 . . . . 1.67 111.508 -178.548 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 35.9 tp -64.96 -47.2 78.46 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.732 0.301 . . . . 1.48 110.743 -177.59 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.636 HG13 HD22 ' A' ' 80' ' ' LEU . 37.2 t -57.31 -48.32 82.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.98 -0.554 . . . . 0.82 110.701 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -61.19 -33.58 73.69 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.652 -0.249 . . . . 1.14 111.533 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 95.9 m -63.62 -56.16 17.97 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 111.804 0.298 . . . . 0.69 111.804 -178.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.2 mp -76.78 -46.84 29.62 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 CA-C-O 121.317 0.58 . . . . 0.77 110.744 -178.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.948 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 9.1 mp -73.16 -3.6 27.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.879 -0.6 . . . . 0.78 111.589 -175.139 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 48.0 tptt -50.64 -63.69 1.04 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.635 -0.506 . . . . 1.93 109.635 170.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -75.07 -36.49 61.77 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.417 -0.356 . . . . 2.91 110.622 177.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.948 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 34.4 tt0 -57.09 -45.32 83.45 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.349 -0.387 . . . . 1.66 111.895 -176.655 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 42.4 mt -56.81 -30.78 64.05 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.471 0.545 . . . . 0.58 112.471 -177.606 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -54.93 -24.57 24.3 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 120.857 0.36 . . . . 0.92 111.5 -174.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -91.44 -4.78 55.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.247 -0.433 . . . . 1.02 111.129 -175.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.444 HD11 HG12 ' A' ' 29' ' ' ILE . 6.0 mt -124.25 137.65 56.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.444 -0.344 . . . . 0.77 110.187 -176.755 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -75.96 -47.72 23.95 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.626 -0.509 . . . . 1.85 109.626 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.426 ' O ' ' HA ' ' A' ' 54' ' ' SER . . . -141.23 96.65 3.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.987 0.423 . . . . 0.78 111.217 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -92.79 144.61 25.12 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.167 -0.469 . . . . 0.63 110.155 175.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 50.0 m -135.51 162.09 33.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.188 -0.46 . . . . 1.27 109.773 175.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -144.95 148.87 34.31 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.976 0.417 . . . . 0.64 110.845 -178.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -125.34 109.09 12.36 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.798 -0.816 . . . . 2.23 108.798 174.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 7.9 p -93.78 124.75 37.99 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.721 0.296 . . . . 1.38 111.688 -173.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.493 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 22.1 m-70 -147.95 174.19 12.13 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 121.183 0.516 . . . . 1.98 111.122 176.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.685 ' HB ' ' HD2' ' A' ' 97' ' ' PRO . 72.2 p -116.46 164.3 18.8 Favored Pre-proline 0 C--O 1.243 0.746 0 CA-C-N 116.014 -0.539 . . . . 0.76 111.451 -177.488 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.685 ' HD2' ' HB ' ' A' ' 96' ' ' THR . 14.5 Cg_endo -57.69 -20.75 44.1 Favored 'Trans proline' 0 C--O 1.219 -0.425 0 C-N-CA 122.826 2.35 . . . . 0.72 112.138 178.105 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.549 ' O ' ' HD2' ' A' ' 102' ' ' LYS . 4.0 mm? -62.46 -51.15 68.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.706 0.289 . . . . 2.08 110.236 177.62 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.574 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 3.4 mp0 -61.54 -46.32 90.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.398 . . . . 2.69 110.567 177.618 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -67.03 -42.49 84.78 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.517 -0.473 . . . . 1.46 111.75 -177.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.535 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 24.9 t70 -64.87 -33.04 75.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.855 0.36 . . . . 1.23 110.45 -178.366 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.613 ' O ' ' HG3' ' A' ' 106' ' ' LYS . 1.1 mpmm? -73.9 -20.3 60.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.518 -0.31 . . . . 2.66 110.978 177.613 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 82.1 mt -70.69 -49.73 44.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.082 0.468 . . . . 1.31 109.915 174.573 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.535 ' HG3' ' O ' ' A' ' 101' ' ' ASP . 2.7 ptmt -68.03 -23.68 65.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.08 -0.509 . . . . 1.84 110.778 174.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.552 ' HB3' ' HA ' ' A' ' 102' ' ' LYS . 44.2 t -74.92 -75.47 0.17 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.38 -0.373 . . . . 2.05 110.46 177.453 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.613 ' HG3' ' O ' ' A' ' 102' ' ' LYS . 10.8 pttt -97.42 -53.19 3.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.586 0.231 . . . . 4.02 111.023 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 109.07 -3.05 31.51 Favored Glycine 0 C--N 1.329 0.183 0 C-N-CA 120.612 -0.804 . . . . 3.92 112.899 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 8.2 t . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.756 -0.64 . . . . 4.98 109.63 179.633 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.2 ttp . . . . . 0 N--CA 1.482 1.134 0 N-CA-C 109.572 -0.529 . . . . 36.14 109.572 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 89.0 7.9 69.82 Favored Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 110.472 -1.051 . . . . 33.7 110.472 -171.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -96.66 87.05 4.24 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.0 -0.6 . . . . 32.35 110.091 -177.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.4 m -75.12 135.6 41.15 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.156 -0.475 . . . . 30.38 110.697 -179.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -112.97 117.92 33.39 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.716 -0.476 . . . . 28.39 109.716 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -122.58 99.36 6.36 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.04 0.448 . . . . 28.54 112.026 -176.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.8 m80 -78.38 136.28 37.64 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.814 -0.63 . . . . 26.47 109.502 170.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 78.3 m80 -77.24 115.19 16.81 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.11 -0.495 . . . . 24.34 109.94 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 7.2 p-80 -94.47 138.48 32.34 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.429 -0.582 . . . . 23.8 109.429 177.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 48.6 t-80 -93.22 98.33 11.21 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.873 -0.417 . . . . 20.9 109.873 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 21.3 t -68.33 127.9 34.63 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.242 -0.651 . . . . 19.89 109.242 178.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.0 t -114.35 153.38 29.91 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.944 0.402 . . . . 17.26 110.477 -175.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 158.61 65.52 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.593 -0.603 . . . . 16.67 111.593 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -94.89 -51.8 4.52 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.132 0.491 . . . . 19.13 109.857 -177.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -91.48 22.37 4.03 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.844 -0.616 . . . . 14.57 110.205 178.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -68.72 2.21 2.68 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.559 -0.746 . . . . 15.4 112.642 -175.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 mt -114.96 -10.99 12.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.009 0.433 . . . . 16.35 110.424 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -118.16 105.87 12.26 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.077 0.465 . . . . 15.41 111.299 -168.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 29.1 p90 -100.45 -10.84 20.71 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.785 -0.643 . . . . 11.39 111.108 178.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 57.37 42.02 25.49 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.156 -0.475 . . . . 10.77 111.97 177.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.3 31.92 2.59 Favored Glycine 0 CA--C 1.519 0.294 0 C-N-CA 120.885 -0.674 . . . . 6.73 113.07 -177.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 19.2 p80 -99.69 10.16 41.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.277 0.561 . . . . 6.08 110.27 177.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.2 mmt -110.73 166.62 10.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.59 -0.732 . . . . 4.41 109.467 175.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.492 ' O ' HG23 ' A' ' 28' ' ' VAL . 53.5 t -63.07 147.43 50.78 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.731 -0.47 . . . . 1.71 109.731 175.085 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.544 HD11 ' HB3' ' A' ' 86' ' ' ASN . 6.3 tp -49.49 -47.74 20.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 N-CA-C 112.19 0.441 . . . . 1.37 112.19 -175.052 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -63.72 -44.08 94.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.802 0.334 . . . . 1.75 110.322 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -64.73 -36.02 82.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.923 -0.58 . . . . 2.5 111.235 -178.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 24' ' ' CYS . 95.6 t -58.87 -55.54 22.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 N-CA-C 110.37 -0.233 . . . . 1.04 110.37 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.438 HG21 HD11 ' A' ' 87' ' ' ILE . 1.9 mp -66.19 -42.19 90.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.894 0.378 . . . . 0.79 110.586 -179.522 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -58.67 -52.2 66.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.909 -0.587 . . . . 2.2 111.534 -177.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -73.71 -31.29 63.32 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.413 -0.358 . . . . 1.67 110.81 -172.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 mmmp? -60.78 -55.57 31.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.209 -0.45 . . . . 2.03 111.578 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.411 HD12 ' N ' ' A' ' 34' ' ' SER . 4.0 pp -70.33 -26.58 63.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.73 0.3 . . . . 0.57 110.8 -179.564 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.477 ' O ' ' HA ' ' A' ' 38' ' ' LYS . 70.0 m -69.22 -34.17 74.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.765 0.316 . . . . 1.29 110.518 175.636 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.6 m -71.68 -34.32 69.58 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.909 0.385 . . . . 0.78 110.788 175.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.27 -54.85 7.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.012 -0.54 . . . . 0.64 111.92 -177.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.7 mt -89.25 -29.33 19.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.645 0.259 . . . . 0.94 111.066 -176.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.49 ' HE3' ' HB2' ' A' ' 38' ' ' LYS . 17.5 ttmt 60.99 78.78 0.3 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.737 -0.665 . . . . 3.36 111.33 176.716 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.487 ' HG2' ' HB2' ' A' ' 42' ' ' LEU . 59.1 Cg_endo -94.76 160.94 1.81 Allowed 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 123.309 2.673 . . . . 0.63 113.388 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 31.6 p -86.11 -39.82 16.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.665 0.745 . . . . 0.73 109.096 174.172 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.538 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 89.2 t80 -124.02 128.19 48.99 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.883 -1.053 . . . . 0.76 109.395 176.054 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.487 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 2.7 tm? -140.57 115.79 9.91 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.174 -0.676 . . . . 1.55 109.174 -178.212 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -130.37 132.43 45.8 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.832 0.348 . . . . 2.23 111.437 -177.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.8 mp -108.52 115.7 30.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.986 -0.552 . . . . 1.72 109.855 172.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.492 HG23 ' HB3' ' A' ' 56' ' ' ASP . 11.0 m -106.48 149.42 9.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.344 -0.389 . . . . 1.08 110.813 177.445 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -64.44 120.02 11.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.602 -0.726 . . . . 1.83 110.046 176.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.3 tttp -120.23 88.5 2.95 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.885 -0.783 . . . . 2.76 108.885 178.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.3 m -60.77 102.01 0.17 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.072 0.463 . . . . 3.2 111.741 -175.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 78.7 m -105.41 -66.98 0.94 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.818 -0.628 . . . . 4.74 109.562 173.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 157.14 144.7 4.0 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.08 -1.057 . . . . 3.16 113.42 175.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 71.5 m 57.82 83.92 0.11 Allowed 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 123.412 0.685 . . . . 4.36 112.733 174.184 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 100.42 -160.89 19.01 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.433 -0.889 . . . . 2.26 112.486 175.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.486 ' OG1' ' HA ' ' A' ' 87' ' ' ILE . 37.3 p -77.08 135.23 38.6 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.332 0.587 . . . . 3.46 111.527 -177.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.9 m -144.04 114.43 7.52 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.19 -0.67 . . . . 1.71 109.19 176.228 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -131.49 147.4 52.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.043 0.449 . . . . 1.15 111.74 -172.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.492 ' HB3' HG23 ' A' ' 45' ' ' VAL . 5.6 t70 -110.4 119.03 37.91 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.343 -0.984 . . . . 1.35 108.343 173.569 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -107.03 123.02 47.59 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.117 0.484 . . . . 0.51 111.786 -175.514 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.8 t -94.41 111.45 25.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.678 -0.692 . . . . 0.55 109.203 174.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.579 HG23 ' HA ' ' A' ' 94' ' ' CYS . 0.0 OUTLIER -108.97 115.66 50.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 121.562 0.696 . . . . 1.18 110.636 -178.111 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.538 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 85.3 t -112.3 106.17 20.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.025 -0.989 . . . . 0.58 109.029 176.49 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.506 ' HB3' HD11 ' A' ' 59' ' ' ILE . 29.8 t -145.04 154.8 42.9 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.413 0.523 . . . . 0.84 112.413 -172.495 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.738 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 5.4 m-20 -66.87 -19.48 65.74 Favored 'General case' 0 C--O 1.221 -0.419 0 CA-C-N 115.334 -0.848 . . . . 1.67 110.742 171.894 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -69.27 2.17 3.14 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.088 0.471 . . . . 1.81 111.028 -178.097 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -124.59 4.25 8.26 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.754 0.312 . . . . 3.19 111.126 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.738 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.2 OUTLIER -74.88 -9.6 58.7 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 121.892 -0.505 . . . . 2.14 111.636 -176.965 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.6 p-10 -87.44 -9.98 53.17 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.968 0.414 . . . . 2.03 109.995 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.8 ttpp 64.67 25.14 13.04 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.174 -0.921 . . . . 3.31 111.32 173.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.536 ' HE3' HD11 ' A' ' 70' ' ' LEU . 30.4 mmmt -94.67 89.83 5.89 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.358 0.599 . . . . 1.99 109.617 176.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.471 HD12 ' N ' ' A' ' 70' ' ' LEU . 4.0 pp -69.19 -30.31 68.47 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.763 -0.653 . . . . 2.33 110.994 -174.126 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.536 HD11 ' HE3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -67.32 -33.88 76.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.651 0.263 . . . . 1.09 110.573 177.204 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.5 ' N ' HD22 ' A' ' 70' ' ' LEU . 25.5 t70 -74.22 -40.21 62.6 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.676 -0.49 . . . . 2.08 109.676 178.188 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -59.11 -44.44 91.99 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.425 -0.583 . . . . 2.93 109.425 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -57.7 -55.25 37.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.662 -0.699 . . . . 1.21 111.255 178.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.458 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 2.3 ptm180 -61.5 -41.51 97.39 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 111.784 0.29 . . . . 1.67 111.784 -175.558 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.5 mt -64.18 -50.88 66.39 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.883 0.373 . . . . 1.48 110.786 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.412 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 54.1 t -56.28 -45.7 81.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.84 -0.618 . . . . 0.82 110.92 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -64.36 -31.29 72.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.633 -0.258 . . . . 1.14 111.413 -178.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 85.2 m -66.03 -49.32 68.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.572 -0.286 . . . . 0.69 111.408 -178.172 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.1 mp -79.45 -46.0 23.27 Favored 'Isoleucine or valine' 0 C--O 1.242 0.666 0 CA-C-O 121.364 0.602 . . . . 0.77 110.701 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.838 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.8 mp -73.15 -5.46 39.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.074 -0.512 . . . . 0.78 111.711 -175.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -49.46 -63.94 0.95 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.215 -0.291 . . . . 1.93 110.215 171.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.472 ' O ' ' HG2' ' A' ' 85' ' ' GLN . 6.0 tp10 -75.1 -37.6 61.45 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.264 0.554 . . . . 2.91 110.507 175.85 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.838 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 3.8 tp10 -53.01 -55.15 25.78 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.412 -0.813 . . . . 1.66 112.603 -174.714 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.652 ' HG ' ' HB3' ' A' ' 80' ' ' LEU . 55.3 mt -50.4 -30.53 12.62 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.846 -1.07 . . . . 0.58 113.386 -176.731 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.472 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 19.5 mm-40 -51.16 -27.35 8.44 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.018 0.372 . . . . 0.92 111.67 -176.299 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.544 ' HB3' HD11 ' A' ' 25' ' ' ILE . 44.5 m-80 -77.74 -24.82 48.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.386 -0.37 . . . . 1.02 111.337 -178.507 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.486 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 1.8 mt -103.64 156.87 5.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.451 -0.574 . . . . 0.77 109.451 -176.265 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 39.4 t60 -98.46 -36.73 9.85 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.548 -0.461 . . . . 1.85 110.173 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -147.54 96.84 2.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.118 -0.492 . . . . 0.78 110.679 178.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -101.09 136.09 41.49 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.174 -0.466 . . . . 0.63 110.887 178.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 33.0 t -125.76 152.51 45.28 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.111 -0.7 . . . . 1.27 109.111 177.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -143.39 134.72 26.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.306 0.574 . . . . 0.64 111.505 -177.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -117.42 109.28 16.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.646 -0.706 . . . . 2.23 109.412 174.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.579 ' HA ' HG23 ' A' ' 59' ' ' ILE . 7.5 p -92.77 130.62 38.32 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.276 0.56 . . . . 1.38 111.555 -176.733 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.414 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 89.8 m-70 -143.88 167.08 23.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.586 -0.733 . . . . 1.98 110.017 178.174 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 39.1 p -101.63 159.15 30.26 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 116.238 -0.437 . . . . 0.76 110.006 176.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -58.68 -29.44 89.43 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.252 1.968 . . . . 0.72 111.166 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.85 -45.48 70.97 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.542 -0.754 . . . . 2.08 109.781 177.129 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.483 ' HA ' ' CE ' ' A' ' 102' ' ' LYS . 8.5 tp10 -61.95 -42.55 99.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.044 0.449 . . . . 2.69 110.284 177.656 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.614 ' O ' ' HG2' ' A' ' 104' ' ' LYS . 64.9 t80 -64.66 -32.53 74.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.683 -0.689 . . . . 1.46 110.429 178.062 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -59.45 -36.49 76.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.052 -0.522 . . . . 1.23 111.266 -178.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.483 ' CE ' ' HA ' ' A' ' 99' ' ' GLU . 0.0 OUTLIER -63.64 -44.66 93.19 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.962 -0.295 . . . . 2.66 110.518 176.592 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 51.7 mt -63.04 -51.5 66.49 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.177 -0.465 . . . . 1.31 110.948 -176.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.614 ' HG2' ' O ' ' A' ' 100' ' ' TYR . 19.3 ptmt -68.35 -18.72 64.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.796 -0.638 . . . . 1.84 111.755 -177.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 47.4 t -62.12 -26.26 68.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.834 0.349 . . . . 2.05 111.041 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.453 ' HE3' ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -117.71 -39.48 3.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.021 0.439 . . . . 4.02 110.532 176.747 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 104.7 47.82 1.15 Allowed Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.999 -0.619 . . . . 3.92 111.699 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 24.1 m . . . . . 0 C--O 1.252 1.211 0 CA-C-O 118.491 -0.766 . . . . 4.98 109.828 -179.547 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 tpt . . . . . 0 N--CA 1.48 1.073 0 CA-C-O 120.942 0.401 . . . . 36.14 110.519 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 166.42 168.05 28.02 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 111.131 -0.788 . . . . 33.7 111.131 178.334 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.1 t -74.83 90.3 2.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.283 0.563 . . . . 32.35 109.831 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.6 m -84.68 91.87 8.04 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.901 -0.591 . . . . 30.38 110.991 -176.274 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 59.5 m-70 -95.41 -172.36 2.62 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.191 -0.459 . . . . 28.39 110.485 179.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 -124.38 -47.41 1.87 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.708 -0.478 . . . . 28.54 109.708 178.054 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 69.38 -52.79 0.6 Allowed 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.275 1.03 . . . . 26.47 111.673 178.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 -64.23 135.27 56.12 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.96 -0.755 . . . . 24.34 108.96 177.346 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 46.6 m80 -84.54 -79.38 0.22 Allowed 'General case' 0 C--N 1.323 -0.582 0 O-C-N 123.388 0.43 . . . . 23.8 112.042 -167.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -143.53 133.52 24.15 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.358 -0.383 . . . . 20.9 110.147 -172.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.5 m -105.05 -163.34 0.95 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.192 -0.458 . . . . 19.89 110.143 -178.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.7 m -98.0 70.86 2.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.239 0.542 . . . . 17.26 110.578 176.309 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.467 ' HA3' ' HG3' ' A' ' 43' ' ' GLU . . . -117.38 23.76 9.55 Favored Glycine 0 N--CA 1.452 -0.24 0 N-CA-C 110.601 -1.0 . . . . 16.67 110.601 178.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -67.66 -32.47 73.18 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.392 -0.904 . . . . 19.13 111.631 -175.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -129.45 12.55 5.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.143 0.497 . . . . 14.57 110.582 -173.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -73.18 -6.51 46.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.973 -0.558 . . . . 15.4 111.207 -173.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -71.97 -1.31 14.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.445 -0.343 . . . . 16.35 111.893 -174.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -97.24 131.7 43.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.899 0.381 . . . . 15.41 110.473 177.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -90.03 -30.58 17.65 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.01 -0.541 . . . . 11.39 110.284 -174.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 66.58 19.54 10.83 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.263 -0.88 . . . . 10.77 111.041 177.227 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.03 -2.53 86.73 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.995 -0.621 . . . . 6.73 112.783 178.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 32.2 m170 -96.39 107.86 20.31 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.737 -0.272 . . . . 6.08 110.403 -178.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.8 ptt? -79.81 65.7 5.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.684 0.754 . . . . 4.41 110.831 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 33.7 m -68.82 155.97 39.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.378 -0.828 . . . . 1.71 110.126 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.9 tp -56.1 -35.62 42.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 O-C-N 123.075 0.235 . . . . 1.37 110.893 -178.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -53.27 -49.98 65.8 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.86 0.362 . . . . 1.75 110.763 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.456 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 70.3 mmtt -71.32 -23.89 62.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.965 -0.562 . . . . 2.5 112.187 -174.525 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 46.4 t -67.22 -52.21 45.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-O 121.163 0.506 . . . . 1.04 109.844 176.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.416 HG13 ' OE1' ' A' ' 83' ' ' GLU . 1.8 mp -60.42 -48.56 87.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.413 -0.812 . . . . 0.79 109.905 175.713 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -56.4 -49.71 73.72 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.086 -0.961 . . . . 2.2 111.117 -178.041 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -56.33 -50.74 70.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.146 -0.479 . . . . 1.67 111.767 -177.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.3 mtmp? -63.28 -46.83 84.94 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.415 0.524 . . . . 2.03 112.415 -175.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.447 HD12 ' N ' ' A' ' 34' ' ' SER . 4.3 pp -71.42 -28.83 64.27 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.24 -0.584 . . . . 0.57 110.848 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.447 ' N ' HD12 ' A' ' 33' ' ' LEU . 23.1 t -69.21 -36.93 77.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.931 0.396 . . . . 1.29 110.149 177.192 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.1 m -71.6 -28.0 63.51 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.409 -0.359 . . . . 0.78 111.189 178.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.09 -54.92 5.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.313 -0.403 . . . . 0.64 112.005 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.6 mp -88.86 -25.68 22.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.601 0.238 . . . . 0.94 110.639 -177.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.459 ' HE2' ' HB2' ' A' ' 38' ' ' LYS . 19.9 ttmm 59.82 78.18 0.35 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.56 -0.746 . . . . 3.36 111.373 177.503 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.847 ' HA ' ' HB3' ' A' ' 61' ' ' SER . 97.4 Cg_endo -93.0 157.93 2.68 Favored 'Trans proline' 0 N--CA 1.451 -1.024 0 C-N-CA 123.177 2.585 . . . . 0.63 113.167 -177.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.0 p -89.65 -28.05 19.74 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.813 -0.63 . . . . 0.73 109.826 175.084 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.431 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 83.4 t80 -138.3 139.77 39.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.687 -0.688 . . . . 0.76 110.13 178.233 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.631 HD22 ' HA ' ' A' ' 59' ' ' ILE . 0.2 OUTLIER -142.21 116.36 9.45 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.228 -0.656 . . . . 1.55 109.228 179.135 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.467 ' HG3' ' HA3' ' A' ' 13' ' ' GLY . 21.4 tt0 -114.54 127.78 55.98 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.947 0.403 . . . . 2.23 110.263 177.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -98.94 115.79 29.7 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.765 -0.652 . . . . 1.72 110.214 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.534 ' HB ' ' HB3' ' A' ' 56' ' ' ASP . 29.6 t -103.49 146.22 11.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.453 -0.794 . . . . 1.08 109.32 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -69.79 129.87 40.75 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.832 -0.433 . . . . 1.83 109.832 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.682 ' HA ' ' HE3' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -72.41 -31.9 65.9 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.047 0.451 . . . . 2.76 110.044 -179.883 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.2 t -172.68 98.91 0.14 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.426 -0.806 . . . . 3.2 109.069 -178.047 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 70.9 m -54.37 110.9 0.68 Allowed 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.741 -0.663 . . . . 4.74 110.768 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 143.47 -31.49 1.92 Allowed Glycine 0 N--CA 1.442 -0.913 0 CA-C-N 115.069 -0.968 . . . . 3.16 111.334 -177.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 57.9 m -131.29 105.03 7.38 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.891 0.377 . . . . 4.36 110.359 178.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -83.84 54.27 4.93 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.992 -0.623 . . . . 2.26 112.303 -178.309 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.7 t -126.4 -1.31 6.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.299 0.571 . . . . 3.46 110.657 -179.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.0 p -137.77 138.29 39.1 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.377 -0.374 . . . . 1.71 110.288 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -128.3 152.45 48.12 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.251 0.548 . . . . 1.15 111.652 -175.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.534 ' HB3' ' HB ' ' A' ' 45' ' ' VAL . 13.7 t70 -113.67 134.2 54.87 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.232 -1.025 . . . . 1.35 108.232 174.086 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -125.31 120.99 32.71 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.279 0.561 . . . . 0.51 112.378 -174.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.3 t -92.52 110.98 23.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.484 -0.78 . . . . 0.55 108.996 171.352 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.631 ' HA ' HD22 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -105.4 120.47 56.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.252 -0.431 . . . . 1.18 110.576 -176.899 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.482 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 58.1 t -115.79 106.92 21.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.73 -0.668 . . . . 0.58 110.373 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.847 ' HB3' ' HA ' ' A' ' 39' ' ' PRO . 86.9 p -153.37 153.09 31.9 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.884 0.374 . . . . 0.84 111.048 -179.019 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.851 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 7.9 m120 -67.17 -19.35 65.57 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.122 -0.49 . . . . 1.67 112.078 175.239 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -52.5 -25.43 10.25 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.868 -0.52 . . . . 1.81 111.505 -177.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -100.37 -1.34 36.28 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.685 0.624 . . . . 3.19 112.685 -174.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.851 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -72.98 -15.59 61.54 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.542 -0.724 . . . . 2.14 111.669 -178.938 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -80.18 5.25 14.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.136 0.493 . . . . 2.03 110.317 -178.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt 62.58 26.74 15.86 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.355 -0.839 . . . . 3.31 110.803 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.615 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 71.0 mmtt -83.77 97.9 9.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.912 -0.586 . . . . 1.99 111.799 -177.161 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -73.69 -44.11 57.45 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 115.404 -0.817 . . . . 2.33 108.906 175.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.485 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.74 -33.17 74.34 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.012 -0.54 . . . . 1.09 111.503 -178.042 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.615 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 30.6 t70 -66.82 -50.29 63.08 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 109.749 -0.463 . . . . 2.08 109.749 177.363 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -57.42 -43.64 83.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.74 -0.664 . . . . 2.93 109.591 176.427 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -61.45 -50.94 70.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.658 -0.701 . . . . 1.21 111.708 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.07 -35.81 66.74 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.072 -0.251 . . . . 1.67 111.319 -174.358 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.0 mp -64.3 -50.09 69.21 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.792 0.33 . . . . 1.48 110.801 177.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.799 HG13 HD22 ' A' ' 80' ' ' LEU . 42.0 t -58.73 -47.52 88.77 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.4 0 CA-C-N 116.048 -0.524 . . . . 0.82 110.976 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.441 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 13.2 m-80 -62.47 -38.26 89.15 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.905 -0.318 . . . . 1.14 111.702 -178.255 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 87.6 m -61.4 -57.87 10.5 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.06 0.393 . . . . 0.69 112.06 -177.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.402 ' N ' HD12 ' A' ' 79' ' ' ILE . 3.7 mp -81.37 -46.09 20.47 Favored 'Isoleucine or valine' 0 C--O 1.239 0.522 0 CA-C-O 121.457 0.646 . . . . 0.77 110.839 -175.474 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.869 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.6 mp -74.55 -5.35 42.32 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.867 -0.606 . . . . 0.78 111.504 -175.204 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 20.5 tptm -49.73 -63.64 1.05 Allowed 'General case' 0 C--O 1.227 -0.117 0 N-CA-C 109.772 -0.455 . . . . 1.93 109.772 169.091 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -75.2 -30.19 60.57 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.294 0.569 . . . . 2.91 110.322 179.377 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.869 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 6.7 tp10 -56.8 -55.59 32.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.553 -0.748 . . . . 1.66 112.001 -179.191 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.658 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 75.0 mt -50.37 -30.77 13.0 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.173 -0.921 . . . . 0.58 112.634 -178.361 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 22.2 mm-40 -52.76 -30.76 34.62 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 120.954 0.407 . . . . 0.92 111.163 -176.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -96.57 5.36 50.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.199 -0.455 . . . . 1.02 111.395 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 9.1 mt -122.89 136.62 59.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.507 -0.315 . . . . 0.77 110.285 -178.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -73.38 -38.68 65.58 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.939 0.399 . . . . 1.85 110.226 179.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.32 102.0 1.09 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.899 -0.592 . . . . 0.78 110.416 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -94.64 140.22 30.16 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.388 -0.369 . . . . 0.63 110.221 177.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.8 m -128.83 140.19 51.82 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.335 -0.617 . . . . 1.27 109.335 176.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -129.71 133.3 46.97 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.149 0.5 . . . . 0.64 110.909 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 42.1 tptt -124.34 116.36 22.47 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.996 -0.547 . . . . 2.23 109.927 174.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.559 ' HA ' HG23 ' A' ' 59' ' ' ILE . 65.9 m -89.22 134.37 34.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.835 -0.621 . . . . 1.38 111.753 -173.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.482 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 55.9 m-70 -136.84 153.48 50.77 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.187 -0.915 . . . . 1.98 109.393 175.128 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.45 HG21 ' HB3' ' A' ' 65' ' ' GLU . 0.6 OUTLIER -93.54 150.71 39.31 Favored Pre-proline 0 C--N 1.314 -0.958 0 CA-C-N 116.282 -0.417 . . . . 0.76 110.173 174.579 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -57.09 -31.85 91.54 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.707 2.271 . . . . 0.72 112.072 -179.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.406 ' O ' ' HE3' ' A' ' 102' ' ' LYS . 3.1 mm? -67.64 -50.86 55.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.528 -0.76 . . . . 2.08 110.229 176.189 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.67 -27.31 66.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.541 -0.299 . . . . 2.69 111.636 -178.239 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -73.77 -32.69 63.92 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.766 -0.457 . . . . 1.46 109.766 173.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.556 ' HA ' ' HE3' ' A' ' 104' ' ' LYS . 12.9 t70 -59.5 -42.64 92.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.809 -0.632 . . . . 1.23 109.855 177.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.406 ' HE3' ' O ' ' A' ' 98' ' ' LEU . 0.0 OUTLIER -56.8 -32.57 65.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.899 -0.591 . . . . 2.66 110.985 177.12 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 70.2 mt -79.11 -40.2 31.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 1.31 112.088 -176.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.563 ' HD2' ' N ' ' A' ' 105' ' ' SER . 0.1 OUTLIER -91.0 -28.73 17.81 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.503 0.557 . . . . 1.84 112.503 -175.301 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.563 ' N ' ' HD2' ' A' ' 104' ' ' LYS . 60.5 m -73.49 -37.49 65.69 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.902 -0.319 . . . . 2.05 111.096 -177.096 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.16 -172.01 3.73 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.105 0.478 . . . . 4.02 111.307 -178.565 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -129.34 4.81 6.3 Favored Glycine 0 N--CA 1.451 -0.361 0 CA-C-N 115.468 -0.787 . . . . 3.92 111.33 177.227 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 18.9 t . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.464 -0.779 . . . . 4.98 109.022 179.698 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.9 mtt . . . . . 0 N--CA 1.482 1.161 0 CA-C-O 120.53 0.205 . . . . 36.14 110.478 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 77.95 -125.4 7.2 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.809 -0.71 . . . . 33.7 111.542 -178.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 6.3 t -142.94 126.53 16.89 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.498 -0.556 . . . . 32.35 109.498 176.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.5 m -83.79 85.01 7.36 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.038 0.447 . . . . 30.38 111.163 -175.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 41.7 m80 -119.42 80.42 1.56 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.436 0.636 . . . . 28.39 111.147 177.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -157.17 96.5 1.58 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.118 -0.946 . . . . 28.54 108.565 174.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 59.7 t60 -95.35 131.15 41.76 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.716 -0.675 . . . . 26.47 111.857 -170.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -139.34 126.47 21.21 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.328 -0.851 . . . . 24.34 109.699 171.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -82.15 71.57 9.2 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.796 -0.816 . . . . 23.8 108.796 176.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.473 ' CD2' ' HG3' ' A' ' 15' ' ' GLU . 0.9 OUTLIER -84.1 174.43 10.27 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.06 -0.973 . . . . 20.9 111.243 -178.701 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.8 m -54.32 126.65 24.04 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.569 -0.741 . . . . 19.89 111.631 -176.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 28.7 m -78.01 88.35 4.16 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.484 0.659 . . . . 17.26 110.306 178.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 171.0 -78.79 0.09 OUTLIER Glycine 0 N--CA 1.442 -0.903 0 CA-C-N 114.966 -1.015 . . . . 16.67 111.277 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -58.01 -27.77 63.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.472 -0.364 . . . . 19.13 111.719 -176.026 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.473 ' HG3' ' CD2' ' A' ' 10' ' ' HIS . 12.8 pt-20 -145.65 36.63 1.07 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.968 0.413 . . . . 14.57 111.315 -174.133 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -96.68 -18.49 19.65 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.513 -0.475 . . . . 15.4 111.074 -178.071 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -82.05 5.18 20.25 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.63 -0.259 . . . . 16.35 111.519 -176.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -81.53 -179.37 7.35 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.485 0.66 . . . . 15.41 112.165 -176.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 14.3 p90 -68.15 -8.45 38.68 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.112 -0.949 . . . . 11.39 113.48 -171.243 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.546 HE21 ' N ' ' A' ' 21' ' ' GLY . 0.4 OUTLIER -74.2 -14.46 60.94 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.095 0.474 . . . . 10.77 110.333 -177.936 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.546 ' N ' HE21 ' A' ' 20' ' ' GLN . . . -91.98 74.06 1.5 Allowed Glycine 0 N--CA 1.446 -0.684 0 CA-C-N 115.806 -0.633 . . . . 6.73 111.824 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.437 ' HB3' ' H ' ' A' ' 23' ' ' MET . 1.8 m80 -102.32 -156.28 0.55 Allowed 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.523 -0.177 . . . . 6.08 110.523 178.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.437 ' H ' ' HB3' ' A' ' 22' ' ' HIS . 26.7 ptt? -50.3 129.41 21.5 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.374 0.607 . . . . 4.41 111.801 -175.298 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.511 ' O ' HG23 ' A' ' 28' ' ' VAL . 48.2 t -176.27 164.51 2.69 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.85 -1.167 . . . . 1.71 107.85 -175.101 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 7.0 tp -59.08 -38.7 75.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.106 0.479 . . . . 1.37 110.218 177.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -63.4 -39.27 94.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.912 -0.586 . . . . 1.75 110.165 176.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -69.66 -33.83 73.14 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.98 -0.555 . . . . 2.5 110.782 -179.571 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 24' ' ' CYS . 94.8 t -57.61 -53.02 50.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 110.202 -0.296 . . . . 1.04 110.202 176.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.9 mp -68.08 -45.35 83.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.244 -0.434 . . . . 0.79 111.181 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -61.38 -52.27 65.31 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.648 0.261 . . . . 2.2 110.934 -176.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -69.56 -27.17 64.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.491 -0.322 . . . . 1.67 110.786 -176.098 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.403 ' HE2' ' HB3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -62.61 -55.65 25.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.189 -0.46 . . . . 2.03 111.172 178.489 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.431 HD12 ' N ' ' A' ' 34' ' ' SER . 3.8 pp -74.26 -30.11 61.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.538 -0.301 . . . . 0.57 111.135 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.431 ' N ' HD12 ' A' ' 33' ' ' LEU . 23.1 t -63.9 -51.59 63.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.419 -0.355 . . . . 1.29 110.837 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.0 m -71.27 -27.23 63.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.568 -0.287 . . . . 0.78 111.284 -177.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.28 -53.89 7.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.522 -0.308 . . . . 0.64 111.678 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.4 mt -83.49 -34.97 25.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.525 -0.307 . . . . 0.94 111.344 -176.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.4 mttp 62.83 85.71 0.16 Allowed Pre-proline 0 N--CA 1.464 0.233 0 CA-C-N 115.636 -0.711 . . . . 3.36 111.927 -177.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.419 ' HG2' ' HB2' ' A' ' 42' ' ' LEU . 94.4 Cg_endo -94.49 157.89 1.98 Allowed 'Trans proline' 0 N--CA 1.45 -1.067 0 C-N-CA 123.164 2.576 . . . . 0.63 112.162 175.649 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 21.5 p -78.81 -29.48 44.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.413 0.625 . . . . 0.73 109.539 176.002 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.491 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 82.9 t80 -141.68 134.49 28.7 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.068 -0.969 . . . . 0.76 109.841 175.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.419 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 1.2 tm? -140.63 112.72 7.75 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.024 -0.732 . . . . 1.55 109.024 178.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -113.37 122.32 47.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.76 -0.459 . . . . 2.23 109.76 177.255 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.457 HD11 ' HB3' ' A' ' 55' ' ' PHE . 0.1 OUTLIER -97.97 115.36 28.01 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.618 -0.512 . . . . 1.72 109.618 179.727 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 39.0 t -112.93 135.34 52.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 116.594 -0.276 . . . . 1.08 110.81 -176.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -67.72 112.86 5.05 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.211 -0.663 . . . . 1.83 109.211 171.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.422 ' HB3' ' OG ' ' A' ' 54' ' ' SER . 56.4 tttp -82.94 -27.76 30.32 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.784 -0.644 . . . . 2.76 110.787 -173.43 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.0 m 57.25 27.83 14.24 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.916 -0.583 . . . . 3.2 111.47 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 37.4 t -87.5 108.85 19.22 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.554 -0.535 . . . . 4.74 109.554 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 88.79 -116.19 4.6 Favored Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 120.587 -0.816 . . . . 3.16 111.289 -176.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 76.7 m -152.47 155.74 38.09 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.067 -0.345 . . . . 4.36 110.067 178.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.07 -140.26 22.08 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.925 -0.655 . . . . 2.26 112.788 176.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.5 p -75.2 102.39 4.97 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 121.508 0.67 . . . . 3.46 111.172 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.422 ' OG ' ' HB3' ' A' ' 47' ' ' LYS . 32.6 t -125.31 114.11 18.47 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.06 -0.718 . . . . 1.71 109.06 176.505 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.457 ' HB3' HD11 ' A' ' 44' ' ' LEU . 41.9 m-85 -124.67 132.62 53.39 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.858 0.361 . . . . 1.15 111.268 -172.599 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -115.46 114.46 25.07 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 107.423 -1.325 . . . . 1.35 107.423 171.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.05 117.76 34.88 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.026 0.441 . . . . 0.51 111.523 -172.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.8 t -80.4 110.78 16.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 108.985 -0.746 . . . . 0.55 108.985 173.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -112.65 112.6 41.14 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.663 0.744 . . . . 1.18 110.376 -176.25 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.528 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 75.3 t -110.26 108.72 26.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.082 -0.963 . . . . 0.58 108.931 175.745 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.1 t -149.04 155.04 40.17 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.359 0.6 . . . . 0.84 112.402 -172.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -66.99 -19.44 65.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 114.922 -1.035 . . . . 1.67 111.602 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 35.0 p30 -68.33 -25.39 65.09 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.852 -0.339 . . . . 1.81 111.244 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.489 ' HD2' HG23 ' A' ' 96' ' ' THR . 57.6 t80 -85.72 -12.78 50.28 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.454 0.645 . . . . 3.19 109.723 176.606 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.47 -24.64 34.14 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.299 -0.864 . . . . 2.14 109.027 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -67.49 -21.25 65.52 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.325 -0.852 . . . . 2.03 109.065 173.569 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt 65.06 23.66 12.47 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.005 -0.998 . . . . 3.31 110.966 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -90.74 89.82 7.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.956 -0.566 . . . . 1.99 110.098 177.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.4 tt -61.65 -49.83 74.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.437 -0.801 . . . . 2.33 110.733 -175.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.416 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -63.49 -31.66 72.89 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.716 0.265 . . . . 1.09 111.716 -178.586 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.65 ' O ' ' HG2' ' A' ' 74' ' ' ARG . 12.4 m-20 -73.98 -46.23 45.13 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.113 -0.235 . . . . 2.08 111.42 -179.013 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.406 ' O ' HG23 ' A' ' 76' ' ' VAL . 0.0 OUTLIER -67.3 -26.68 66.64 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.391 -0.524 . . . . 2.93 109.92 176.479 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -70.94 -48.01 55.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.066 -0.516 . . . . 1.21 110.473 176.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.65 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 7.7 ptm180 -63.69 -34.69 78.42 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.524 -0.307 . . . . 1.67 110.759 -178.322 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 95.3 mt -68.03 -50.12 57.3 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.378 -0.374 . . . . 1.48 110.2 177.393 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.582 HG13 HD22 ' A' ' 80' ' ' LEU . 43.5 t -57.4 -41.34 78.34 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 CA-C-N 116.019 -0.537 . . . . 0.82 110.781 178.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -62.15 -45.74 92.06 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.775 0.321 . . . . 1.14 111.203 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 59.1 m -65.52 -45.86 81.84 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.038 0.447 . . . . 0.69 111.361 -175.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 47.3 mt -77.46 -50.68 19.84 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 CA-C-O 121.464 0.65 . . . . 0.77 110.985 -176.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.855 ' HA ' ' CB ' ' A' ' 83' ' ' GLU . 9.7 mp -77.27 -3.97 42.53 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.636 -0.711 . . . . 0.78 111.903 -173.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.2 tptt -52.35 -63.68 1.06 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.601 -0.518 . . . . 1.93 109.601 172.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -75.53 -30.56 59.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.438 -0.347 . . . . 2.91 111.243 174.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.855 ' CB ' ' HA ' ' A' ' 80' ' ' LEU . 2.6 tp10 -54.28 -54.7 36.67 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.048 0.451 . . . . 1.66 111.585 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 66.0 mt -50.34 -30.86 13.09 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.203 -0.908 . . . . 0.58 112.317 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -54.19 -28.14 38.64 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.757 0.313 . . . . 0.92 111.128 -177.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -90.34 -6.89 54.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.869 0.366 . . . . 1.02 111.136 -178.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.531 HG21 ' HB2' ' A' ' 90' ' ' PHE . 4.2 mt -114.9 146.49 19.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.297 -0.411 . . . . 0.77 109.944 -175.27 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 60.9 t60 -95.01 -28.7 14.99 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.848 0.356 . . . . 1.85 110.079 176.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -158.68 95.58 1.32 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.18 -0.464 . . . . 0.78 110.994 178.009 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' PHE . . . . . 0.531 ' HB2' HG21 ' A' ' 87' ' ' ILE . 81.9 t80 -99.39 144.5 28.43 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.222 -0.445 . . . . 0.63 110.702 176.23 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 51.1 m -142.82 147.45 35.47 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.458 -0.571 . . . . 1.27 109.458 173.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -115.19 137.15 52.34 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.279 0.561 . . . . 0.64 111.248 -177.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -111.62 108.84 18.46 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 107.955 -1.128 . . . . 2.23 107.955 175.229 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 6.3 p -100.1 128.57 46.16 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.414 0.524 . . . . 1.38 112.414 -169.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.528 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 44.5 m80 -141.58 159.79 41.49 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-O 121.543 0.687 . . . . 1.98 111.52 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.489 HG23 ' HD2' ' A' ' 64' ' ' PHE . 0.6 OUTLIER -103.28 149.6 37.12 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 114.932 -1.031 . . . . 0.76 110.67 177.362 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.528 ' HA ' ' HB3' ' A' ' 100' ' ' TYR . 22.2 Cg_endo -61.79 -24.81 77.85 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.838 2.359 . . . . 0.72 112.876 -178.536 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.429 HD22 ' HA ' ' A' ' 98' ' ' LEU . 0.3 OUTLIER -61.87 -51.41 68.33 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.803 -0.443 . . . . 2.08 109.803 179.047 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 19.7 mp0 -72.77 -33.36 66.26 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.084 -0.507 . . . . 2.69 111.118 177.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.528 ' HB3' ' HA ' ' A' ' 97' ' ' PRO . 50.0 t80 -58.65 -39.84 81.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.428 -0.351 . . . . 1.46 111.241 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -57.16 -36.1 70.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.997 0.427 . . . . 1.23 110.657 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.712 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.5 OUTLIER -70.44 -35.76 73.55 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.191 -0.459 . . . . 2.66 110.396 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 86.3 mt -65.18 -43.43 91.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 1.31 111.12 -178.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.2 ptmt -75.84 -31.29 59.27 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.373 -0.376 . . . . 1.84 111.023 178.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.3 t -70.04 -42.64 72.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.782 0.325 . . . . 2.05 110.736 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.651 ' HE2' ' HB2' ' A' ' 108' ' ' SER . 22.7 ptmt -70.84 -46.23 63.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.11 0.481 . . . . 4.02 109.947 177.444 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 100.74 40.21 2.97 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.953 -0.641 . . . . 3.92 111.791 178.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.651 ' HB2' ' HE2' ' A' ' 106' ' ' LYS . 67.8 m . . . . . 0 C--O 1.249 1.026 0 CA-C-O 118.096 -0.954 . . . . 4.98 109.459 178.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 N--CA 1.48 1.064 0 N-CA-C 110.062 -0.348 . . . . 36.14 110.062 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -153.32 54.26 0.45 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.718 -0.753 . . . . 33.7 112.24 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.6 m -114.63 110.67 20.13 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.823 0.344 . . . . 32.35 110.602 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 32.5 t -127.41 109.37 11.7 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.065 -0.516 . . . . 30.38 109.967 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.8 p80 -140.42 119.16 12.45 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.141 0.496 . . . . 28.39 110.971 -179.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 57.0 m-70 -112.31 105.24 13.48 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.072 -0.513 . . . . 28.54 110.231 175.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 75.8 t60 -75.32 111.04 10.18 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.115 -0.493 . . . . 26.47 110.402 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.5 m-70 -88.59 86.58 7.03 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.391 0.615 . . . . 24.34 111.015 -177.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 61.4 t60 -177.83 81.39 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.842 -1.072 . . . . 23.8 108.385 175.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.5 p80 -91.03 121.94 33.27 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.792 -0.64 . . . . 20.9 110.947 -175.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.634 ' HB2' ' HG2' ' A' ' 14' ' ' ARG . 16.3 m -75.36 148.17 39.46 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.282 -0.636 . . . . 19.89 109.282 174.063 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.6 m -94.68 105.84 17.8 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.112 0.482 . . . . 17.26 111.341 -174.353 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 93.78 40.46 4.66 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-N 115.81 -0.632 . . . . 16.67 112.426 177.079 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.634 ' HG2' ' HB2' ' A' ' 11' ' ' SER . 38.8 mtm180 -65.89 -38.9 89.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.24 0.543 . . . . 19.13 110.696 -179.241 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -86.45 30.78 0.69 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.764 -0.653 . . . . 14.57 111.558 -176.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -66.14 -13.28 59.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.405 -0.361 . . . . 15.4 110.888 178.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.3 mp -70.63 -28.48 64.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.341 0.591 . . . . 16.35 109.813 174.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -96.81 167.74 10.92 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.379 -0.828 . . . . 15.41 109.796 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.462 ' CE2' ' HA3' ' A' ' 21' ' ' GLY . 17.0 p90 -96.73 15.57 21.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.446 -0.343 . . . . 11.39 111.095 -176.61 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 63.86 35.23 11.16 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.825 -0.625 . . . . 10.77 110.606 179.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.462 ' HA3' ' CE2' ' A' ' 19' ' ' PHE . . . -103.15 66.08 0.36 Allowed Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.825 -0.702 . . . . 6.73 112.057 -179.123 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 13.9 m-70 -80.24 -67.73 0.74 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.006 -1.109 . . . . 6.08 108.006 176.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.4 mtt -128.1 89.86 2.99 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.828 -1.078 . . . . 4.41 108.789 171.201 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.525 ' O ' HG23 ' A' ' 28' ' ' VAL . 53.3 t -58.88 119.6 7.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.876 -0.602 . . . . 1.71 110.523 -178.126 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.9 tp -52.54 -31.99 16.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 O-C-N 123.642 0.589 . . . . 1.37 111.714 -177.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -60.64 -54.87 40.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.903 0.382 . . . . 1.75 110.101 176.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.1 tttp -71.98 -21.8 61.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.155 -0.475 . . . . 2.5 111.495 -178.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.525 HG23 ' O ' ' A' ' 24' ' ' CYS . 72.9 t -59.64 -45.26 94.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 109.644 -0.502 . . . . 1.04 109.644 174.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.12 -41.17 88.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.945 -0.571 . . . . 0.79 110.102 175.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 34' ' ' SER . 68.7 mt-10 -53.76 -52.22 60.88 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.22 -0.446 . . . . 2.2 111.037 178.31 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -75.43 -30.9 60.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.977 -0.556 . . . . 1.67 110.919 -174.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -60.68 -52.56 64.63 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.273 -0.421 . . . . 2.03 110.718 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -74.23 -26.03 60.01 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.847 -0.341 . . . . 0.57 110.699 178.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 30' ' ' GLU . 12.4 t -67.49 -39.19 85.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.321 -0.399 . . . . 1.29 110.413 179.315 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.0 m -71.33 -27.27 63.27 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.879 0.371 . . . . 0.78 110.973 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.43 -45.22 10.72 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.188 0.44 . . . . 0.64 112.188 -175.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 86.3 mt -95.63 -21.96 17.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.676 0.274 . . . . 0.94 111.391 -176.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt 56.11 80.42 0.29 Allowed Pre-proline 0 C--N 1.329 -0.317 0 C-N-CA 123.399 0.68 . . . . 3.36 112.116 -178.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -92.92 138.98 1.64 Allowed 'Trans proline' 0 N--CA 1.446 -1.294 0 C-N-CA 122.938 2.425 . . . . 0.63 111.684 171.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 13.5 p -75.7 -26.86 57.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.225 0.536 . . . . 0.73 109.808 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.485 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 88.2 t80 -140.87 137.35 33.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.338 -0.846 . . . . 0.76 109.757 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 48.4 tp -136.27 117.14 14.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.34 -0.391 . . . . 1.55 110.338 178.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.47 ' HB2' ' CE2' ' A' ' 41' ' ' PHE . 40.5 tt0 -112.63 115.23 28.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.161 -0.472 . . . . 2.23 110.502 -178.06 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -94.28 117.12 29.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 1.72 110.101 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 57.2 t -120.37 127.9 75.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.113 -0.494 . . . . 1.08 111.08 -178.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -75.77 101.36 5.04 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.374 0.607 . . . . 1.83 109.41 172.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.434 ' HE3' ' HB2' ' A' ' 47' ' ' LYS . 20.7 ttmt -101.74 21.67 14.11 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.57 -0.741 . . . . 2.76 110.012 -175.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.54 ' HB3' ' HA2' ' A' ' 52' ' ' GLY . 22.9 t -94.62 134.7 36.92 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.554 -0.748 . . . . 3.2 109.332 175.438 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.7 p -100.31 8.45 43.7 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.941 0.4 . . . . 4.74 111.068 -178.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -122.82 -107.98 1.91 Allowed Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.498 -0.858 . . . . 3.16 112.723 -178.013 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 62.4 m -88.5 1.71 54.31 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.078 0.399 . . . . 4.36 112.078 -174.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.54 ' HA2' ' HB3' ' A' ' 48' ' ' SER . . . 80.12 44.69 8.74 Favored Glycine 0 N--CA 1.45 -0.369 0 N-CA-C 110.668 -0.973 . . . . 2.26 110.668 -174.064 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.1 m -87.3 -6.32 58.57 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.08 -0.56 . . . . 3.46 111.554 -172.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.427 ' HA ' ' O ' ' A' ' 89' ' ' ALA . 26.6 p -138.73 137.61 36.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.994 0.426 . . . . 1.71 111.891 -175.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -111.57 135.97 51.42 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.913 -0.585 . . . . 1.15 109.533 174.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -119.27 118.38 31.1 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.449 -0.575 . . . . 1.35 109.449 179.205 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -109.79 122.77 48.25 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.053 0.454 . . . . 0.51 111.767 -174.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.401 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 61.3 t -91.57 111.64 24.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.746 -0.661 . . . . 0.55 109.265 174.132 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.472 ' CG1' ' HA ' ' A' ' 94' ' ' CYS . 1.4 pp -99.25 138.12 24.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.388 -0.369 . . . . 1.18 110.358 -176.394 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.485 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 66.0 t -124.76 99.76 6.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 108.999 -0.741 . . . . 0.58 108.999 174.437 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 31.4 t -139.25 148.19 42.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.053 0.454 . . . . 0.84 111.8 -174.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -67.66 -19.09 65.16 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.537 -0.756 . . . . 1.67 111.033 174.164 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -56.1 -40.0 73.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.817 0.342 . . . . 1.81 111.908 -175.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -94.25 5.24 52.38 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.942 0.349 . . . . 3.19 111.942 -171.555 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.44 -14.6 60.86 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.873 -0.517 . . . . 2.14 110.318 -178.348 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.546 ' OD2' ' HG2' ' A' ' 68' ' ' LYS . 23.1 t70 -81.27 -12.54 59.06 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.673 -0.694 . . . . 2.03 109.793 174.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt 67.79 35.96 3.72 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.195 -0.911 . . . . 3.31 110.731 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.892 ' HB3' ' HB2' ' A' ' 71' ' ' ASP . 32.2 mmtm -72.6 95.9 1.9 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.059 -0.519 . . . . 1.99 111.225 177.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.44 ' O ' ' HG3' ' A' ' 72' ' ' ARG . 2.8 tm? -73.71 -47.32 40.36 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.759 -0.46 . . . . 2.33 109.759 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.458 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.28 -32.09 72.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.275 -0.421 . . . . 1.09 111.253 -177.966 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.892 ' HB2' ' HB3' ' A' ' 68' ' ' LYS . 3.6 m-20 -73.94 -42.52 60.42 Favored 'General case' 0 CA--C 1.52 -0.209 0 C-N-CA 120.976 -0.29 . . . . 2.08 111.285 179.034 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.465 ' HE ' ' C ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -63.91 -28.32 69.75 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 120.128 -0.629 . . . . 2.93 109.589 178.168 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 54.7 t-80 -65.36 -58.88 4.79 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.19 -0.459 . . . . 1.21 110.064 176.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.526 ' HD3' ' OD1' ' A' ' 71' ' ' ASP . 5.6 ptm180 -63.91 -41.6 97.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.019 -0.537 . . . . 1.67 111.616 -175.099 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 89.2 mt -66.54 -51.39 57.08 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.631 0.253 . . . . 1.48 110.866 -177.612 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.863 HG13 HD22 ' A' ' 80' ' ' LEU . 25.3 t -58.49 -44.94 90.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.439 . . . . 0.82 111.171 -179.211 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.506 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 91.1 m-20 -63.61 -43.11 97.86 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.714 -0.394 . . . . 1.14 111.277 -177.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 35.0 m -67.85 -40.99 83.61 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.138 0.422 . . . . 0.69 112.138 -174.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.573 HG22 ' OE2' ' A' ' 83' ' ' GLU . 17.1 mt -90.07 -52.19 10.96 Favored 'Isoleucine or valine' 0 C--O 1.25 1.106 0 CA-C-O 122.011 0.91 . . . . 0.77 110.826 -175.13 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.863 HD22 HG13 ' A' ' 76' ' ' VAL . 9.7 mp -67.68 -9.85 47.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.352 -0.84 . . . . 0.78 110.477 -179.325 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.506 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 55.5 tptt -47.07 -56.84 5.81 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 109.592 -0.522 . . . . 1.93 109.592 165.374 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.581 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 43.7 mt-10 -74.99 -30.56 61.2 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.078 -0.51 . . . . 2.91 111.253 -179.06 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.595 ' HB2' ' HA ' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -52.56 -56.09 17.69 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 122.353 1.073 . . . . 1.66 110.91 173.764 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.779 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 32.9 mt -50.5 -30.69 13.43 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 112.94 -1.936 . . . . 0.58 112.906 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.581 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 26.1 mm-40 -59.12 -23.63 62.3 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 120.55 -0.46 . . . . 0.92 110.54 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 -102.28 -23.23 14.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.126 -0.488 . . . . 1.02 111.154 -178.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.9 mt -110.3 133.87 54.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.757 0.313 . . . . 0.77 111.03 -174.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 39.1 t60 -72.03 -43.34 65.13 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.853 0.359 . . . . 1.85 110.201 178.108 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.427 ' O ' ' HA ' ' A' ' 54' ' ' SER . . . -145.5 105.03 3.97 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.959 0.409 . . . . 0.78 110.862 178.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -105.37 132.83 51.06 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.0 0.429 . . . . 0.63 110.672 176.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.9 m -123.77 145.96 48.66 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.921 -0.581 . . . . 1.27 109.445 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -132.27 138.65 47.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.299 0.571 . . . . 0.64 111.499 -176.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -109.34 109.22 20.04 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.491 -0.777 . . . . 2.23 109.282 172.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.472 ' HA ' ' CG1' ' A' ' 59' ' ' ILE . 9.0 p -83.34 99.81 10.26 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.967 -0.561 . . . . 1.38 110.336 -176.642 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.5 m170 -118.45 163.01 17.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.452 0.644 . . . . 1.98 111.423 -178.032 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.97 156.32 50.26 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 115.275 -0.875 . . . . 0.76 110.732 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -58.63 -27.88 84.34 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.947 2.431 . . . . 0.72 112.823 -177.278 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.51 -51.21 70.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.977 0.418 . . . . 2.08 109.999 178.537 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.504 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 11.4 mp0 -65.6 -43.68 88.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.907 -0.588 . . . . 2.69 110.666 178.164 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.415 ' O ' ' HG2' ' A' ' 104' ' ' LYS . 66.9 t80 -59.43 -37.39 77.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.095 -0.502 . . . . 1.46 110.938 -179.326 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -57.9 -34.59 69.99 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.298 0.571 . . . . 1.23 110.503 178.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.639 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -78.89 -44.97 21.59 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.5 -0.773 . . . . 2.66 110.466 176.678 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.633 HD23 ' HA2' ' A' ' 107' ' ' GLY . 86.4 mt -60.37 -44.37 95.67 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.032 -0.531 . . . . 1.31 111.894 -176.058 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.415 ' HG2' ' O ' ' A' ' 100' ' ' TYR . 4.4 pttp -63.53 -29.64 70.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.021 0.439 . . . . 1.84 111.088 -179.25 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 21.7 t -83.13 -49.01 9.93 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.123 0.487 . . . . 2.05 109.916 -178.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -153.17 -44.38 0.1 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.655 -0.702 . . . . 4.02 111.406 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.633 ' HA2' HD23 ' A' ' 103' ' ' LEU . . . 93.95 28.18 11.38 Favored Glycine 0 C--N 1.318 -0.423 0 N-CA-C 111.275 -0.73 . . . . 3.92 111.275 -176.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 8.4 t . . . . . 0 C--O 1.252 1.208 0 CA-C-O 118.621 -0.705 . . . . 4.98 109.266 -176.74 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.8 ptp . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 110.355 -0.239 . . . . 36.14 110.355 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 140.27 -170.97 24.15 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.925 -0.655 . . . . 33.7 112.021 179.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 69.6 m -87.9 156.22 19.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.853 0.359 . . . . 32.35 110.496 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 7.5 t -81.61 72.37 8.65 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.334 0.588 . . . . 30.38 110.079 -178.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 25.5 m170 -129.25 27.32 5.36 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.654 -0.703 . . . . 28.39 110.591 178.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -81.58 30.68 0.35 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.168 -0.469 . . . . 28.54 111.539 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -84.77 89.92 7.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.317 -0.401 . . . . 26.47 110.35 -178.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 14.6 p-80 -129.69 139.71 51.29 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.156 -0.475 . . . . 24.34 110.14 177.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 30.8 t60 -108.48 120.95 43.9 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.108 -0.496 . . . . 23.8 110.946 -173.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.2 t-160 -97.04 95.84 8.07 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.079 -0.711 . . . . 20.9 109.079 176.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.4 p -83.3 -60.41 2.15 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.03 -0.532 . . . . 19.89 112.231 -174.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.2 t -81.28 108.64 15.08 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.941 0.4 . . . . 17.26 110.995 -177.08 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -151.67 10.61 0.7 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.933 -0.651 . . . . 16.67 112.373 176.113 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -98.74 -26.04 14.47 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.006 0.432 . . . . 19.13 110.957 -177.42 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -120.5 22.95 11.07 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.211 -0.45 . . . . 14.57 111.774 -170.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -75.24 -1.16 22.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.39 -0.368 . . . . 15.4 110.876 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 82.4 mt -82.95 -18.02 41.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.139 -0.482 . . . . 16.35 110.564 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -101.44 110.07 22.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.048 -0.524 . . . . 15.41 110.22 -178.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.613 ' HA ' ' NE2' ' A' ' 22' ' ' HIS . 53.8 p90 -67.58 -24.38 65.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.988 -0.551 . . . . 11.39 110.879 -177.535 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -59.87 -23.83 63.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.617 -0.719 . . . . 10.77 112.006 -176.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -96.52 18.94 56.58 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.777 -0.725 . . . . 6.73 113.389 -175.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.613 ' NE2' ' HA ' ' A' ' 19' ' ' PHE . 29.0 p80 -159.06 64.37 0.41 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.397 0.618 . . . . 6.08 111.216 177.358 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 88.4 mmm -88.56 -10.18 49.69 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.079 -0.509 . . . . 4.41 110.876 -177.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 67.8 m -89.92 88.75 7.44 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.15 0.5 . . . . 1.71 111.236 -179.035 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 11.9 tt -67.15 -35.87 75.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.914 -0.584 . . . . 1.37 111.325 -177.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -62.12 -36.62 82.31 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 120.743 -0.383 . . . . 1.75 110.128 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.408 ' HD3' ' HB2' ' A' ' 31' ' ' ASP . 15.7 tppt? -65.63 -44.66 85.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.382 -0.372 . . . . 2.5 110.489 178.75 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.0 t -54.59 -54.31 23.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 CA-C-O 120.865 0.364 . . . . 1.04 110.93 178.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.438 HG13 ' OE1' ' A' ' 83' ' ' GLU . 1.8 mp -61.88 -54.64 31.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.029 -0.532 . . . . 0.79 110.992 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -55.41 -52.44 63.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.025 -0.534 . . . . 2.2 111.801 -174.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.408 ' HB2' ' HD3' ' A' ' 27' ' ' LYS . 0.7 OUTLIER -75.04 -28.54 60.46 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.675 -0.41 . . . . 1.67 111.381 -170.613 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.1 ttpm? -67.95 -48.13 66.74 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.615 -0.434 . . . . 2.03 110.665 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.405 HD12 ' N ' ' A' ' 34' ' ' SER . 4.4 pp -72.99 -29.64 63.2 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.781 -0.368 . . . . 0.57 110.944 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.405 ' N ' HD12 ' A' ' 33' ' ' LEU . 66.0 m -70.44 -34.8 72.88 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 116.574 -0.284 . . . . 1.29 111.058 178.632 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 56.4 m -71.59 -27.4 63.1 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.786 0.327 . . . . 0.78 111.2 177.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.7 -49.68 15.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.282 -0.417 . . . . 0.64 111.739 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 91.0 mt -84.15 -31.66 25.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.859 0.361 . . . . 0.94 110.401 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.471 ' HA ' ' HD2' ' A' ' 38' ' ' LYS . 41.5 tptt 55.57 88.46 0.12 Allowed Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 114.959 -1.019 . . . . 3.36 111.695 -176.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.897 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 97.4 Cg_endo -89.18 137.87 3.21 Favored 'Trans proline' 0 N--CA 1.451 -0.997 0 C-N-CA 122.743 2.295 . . . . 0.63 112.606 179.188 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.4 p -69.91 -29.85 67.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.452 0.644 . . . . 0.73 109.735 173.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.779 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 90.8 t80 -140.74 127.94 20.96 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.173 -0.921 . . . . 0.76 109.112 175.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.415 HD22 ' HA ' ' A' ' 42' ' ' LEU . 1.2 tm? -136.28 126.05 25.62 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.518 -0.549 . . . . 1.55 109.518 -178.613 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -129.64 127.84 41.41 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.735 -0.468 . . . . 2.23 109.735 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -94.99 115.75 27.83 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.78 -0.452 . . . . 1.72 109.78 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 60.8 t -103.44 121.76 55.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-N 116.041 -0.527 . . . . 1.08 110.395 -177.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -68.48 111.15 4.52 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.981 -0.554 . . . . 1.83 109.667 177.076 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.715 ' HD3' ' HB2' ' A' ' 56' ' ' ASP . 18.5 tptt -81.08 117.39 21.62 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 108.883 -0.784 . . . . 2.76 108.883 179.641 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.6 t -59.9 114.27 2.72 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.598 -0.728 . . . . 3.2 112.063 -169.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 25.4 p -162.19 154.01 18.74 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.438 -0.801 . . . . 4.74 109.356 173.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -73.83 -66.06 2.07 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.863 -0.684 . . . . 3.16 113.385 -175.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 11.9 p -120.58 14.07 11.79 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.187 0.518 . . . . 4.36 110.757 -176.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -76.74 -41.14 24.61 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.752 -0.737 . . . . 2.26 112.454 -178.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 28.6 m 60.36 82.59 0.16 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.412 0.625 . . . . 3.46 110.41 -176.133 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.426 ' OG ' ' HB3' ' A' ' 47' ' ' LYS . 12.3 p -129.27 140.75 51.32 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.795 -0.639 . . . . 1.71 110.963 -177.303 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -127.4 133.53 49.99 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.323 -0.398 . . . . 1.15 110.818 -178.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.715 ' HB2' ' HD3' ' A' ' 47' ' ' LYS . 27.7 t0 -112.34 115.67 29.13 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.697 -0.853 . . . . 1.35 108.697 177.498 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.85 119.53 39.39 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.208 0.528 . . . . 0.51 111.738 -171.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 48.4 t -84.27 111.32 19.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.646 -0.706 . . . . 0.55 109.33 176.492 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.499 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -107.52 109.29 27.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.712 0.767 . . . . 1.18 110.45 -176.818 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.779 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 97.3 t -106.88 108.66 25.72 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 114.929 -1.032 . . . . 0.58 109.024 175.531 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.897 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 31.2 t -153.38 155.08 35.74 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.064 0.459 . . . . 0.84 111.935 -172.441 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.551 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 89.8 m-20 -62.55 -19.44 63.67 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.409 -0.814 . . . . 1.67 110.476 173.038 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -49.73 -46.62 50.52 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.775 -0.648 . . . . 1.81 111.307 176.518 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -94.17 2.5 55.94 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.898 -0.592 . . . . 3.19 110.812 -175.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.551 ' HB3' ' HA ' ' A' ' 62' ' ' ASN . 0.2 OUTLIER -85.25 -24.58 27.72 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-O 121.4 0.619 . . . . 2.14 109.527 -176.51 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -77.2 1.38 18.6 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.739 -0.664 . . . . 2.03 110.496 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 87.3 mttt 68.8 11.05 8.22 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.344 -0.844 . . . . 3.31 112.7 175.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.6 mmmm -84.51 89.43 7.43 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.155 -0.618 . . . . 1.99 110.229 -178.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.509 HD12 ' N ' ' A' ' 70' ' ' LEU . 3.3 pp -73.77 -34.25 64.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.033 -0.531 . . . . 2.33 111.082 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.509 ' N ' HD12 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -68.0 -33.88 75.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.336 -0.393 . . . . 1.09 111.036 178.387 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.676 ' O ' ' HG2' ' A' ' 74' ' ' ARG . 27.3 m-20 -74.03 -46.17 45.08 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.169 -0.213 . . . . 2.08 111.153 -178.63 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.48 ' HG2' ' HA ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -61.07 -34.51 75.01 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.21 -0.596 . . . . 2.93 109.918 176.84 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -64.44 -50.67 66.66 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.275 -0.421 . . . . 1.21 110.163 179.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.676 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 4.4 ptm180 -66.15 -36.25 82.62 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.218 -0.446 . . . . 1.67 110.944 -177.728 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 92.4 mt -66.94 -53.32 32.97 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.712 0.292 . . . . 1.48 110.659 178.516 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.633 HG13 HD22 ' A' ' 80' ' ' LEU . 54.9 t -58.18 -44.18 87.19 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 CA-C-N 116.029 -0.532 . . . . 0.82 110.895 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.555 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 4.4 m-20 -62.3 -42.03 99.01 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.637 0.236 . . . . 1.14 111.637 -178.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 47.2 m -69.15 -48.91 61.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.923 0.392 . . . . 0.69 111.577 -175.217 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 39.6 mt -75.49 -50.76 22.85 Favored 'Isoleucine or valine' 0 C--O 1.239 0.549 0 CA-C-O 121.522 0.677 . . . . 0.77 110.663 -177.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.9 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 9.6 mp -76.61 -5.36 47.42 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-N 115.631 -0.713 . . . . 0.78 111.377 -175.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.555 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 18.7 tppt? -52.39 -63.63 1.08 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.559 -0.534 . . . . 1.93 109.559 172.296 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -75.36 -30.71 60.29 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.758 -0.655 . . . . 2.91 110.963 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.9 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 5.0 tp10 -55.96 -54.36 45.68 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.003 0.43 . . . . 1.66 111.539 178.81 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.775 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 68.7 mt -50.69 -30.42 13.69 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-N 115.388 -0.824 . . . . 0.58 112.494 -178.608 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 -54.54 -28.29 44.51 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.629 0.252 . . . . 0.92 111.362 -176.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -92.35 0.81 57.47 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.031 0.443 . . . . 1.02 110.951 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.522 HG21 ' HB2' ' A' ' 90' ' ' PHE . 9.5 mt -121.73 143.21 35.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.121 -0.491 . . . . 0.77 109.847 -177.419 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 37.3 t60 -77.85 -46.06 22.51 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.699 -0.482 . . . . 1.85 109.699 176.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -153.77 102.74 2.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.07 -0.514 . . . . 0.78 110.982 178.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' PHE . . . . . 0.522 ' HB2' HG21 ' A' ' 87' ' ' ILE . 83.2 t80 -102.33 131.84 48.69 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.278 -0.419 . . . . 0.63 110.24 175.523 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 31.6 t -122.37 157.53 31.62 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.502 -0.555 . . . . 1.27 109.502 178.06 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -144.43 139.96 28.69 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.078 0.466 . . . . 0.64 110.958 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 26.5 mmtp -121.22 109.13 14.59 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.66 -0.7 . . . . 2.23 109.143 177.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.49 ' HA ' HG23 ' A' ' 59' ' ' ILE . 7.4 p -98.79 131.04 45.22 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.167 0.508 . . . . 1.38 112.23 -172.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.419 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 1.5 m170 -148.75 175.52 11.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.599 -0.728 . . . . 1.98 110.223 174.331 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.405 ' HB ' ' HD2' ' A' ' 97' ' ' PRO . 74.9 p -103.25 159.24 29.9 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.293 -0.412 . . . . 0.76 111.229 -175.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.405 ' HD2' ' HB ' ' A' ' 96' ' ' THR . 20.4 Cg_endo -61.81 -26.41 79.44 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.634 2.222 . . . . 0.72 111.667 176.495 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.65 -48.94 75.19 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.417 -0.586 . . . . 2.08 109.417 178.34 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.554 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 11.4 mm-40 -61.24 -49.61 76.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.671 -0.695 . . . . 2.69 110.597 177.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.557 ' O ' ' HG2' ' A' ' 104' ' ' LYS . 84.5 t80 -59.57 -42.88 93.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.856 -0.611 . . . . 1.46 110.882 -178.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -61.48 -37.69 84.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 1.23 110.842 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.801 ' HA ' ' HE3' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -65.18 -38.35 90.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.412 -0.358 . . . . 2.66 110.998 177.247 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 54.3 mt -66.04 -49.96 65.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.041 -0.527 . . . . 1.31 110.67 -179.482 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.557 ' HG2' ' O ' ' A' ' 100' ' ' TYR . 16.8 ptmt -70.86 -29.63 65.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.158 -0.473 . . . . 1.84 111.582 -178.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 25.2 t -60.0 -55.9 28.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.948 0.404 . . . . 2.05 111.167 -177.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.54 -56.54 1.88 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.425 -0.352 . . . . 4.02 111.84 -176.626 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 129.95 53.0 0.1 Allowed Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.704 -0.76 . . . . 3.92 111.941 -176.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 5.0 p . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.469 -0.777 . . . . 4.98 110.179 177.073 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.475 ' H3 ' ' CD ' ' A' ' 30' ' ' GLU . 96.0 mmm . . . . . 0 N--CA 1.481 1.108 0 N-CA-C 110.184 -0.302 . . . . 36.14 110.184 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 92.09 154.78 31.22 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.871 -0.681 . . . . 33.7 111.772 -177.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 25.4 t -87.84 110.44 20.5 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.609 -0.515 . . . . 32.35 109.609 178.243 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.515 ' OG ' ' HD2' ' A' ' 39' ' ' PRO . 3.6 m -55.28 114.24 1.72 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.759 -0.655 . . . . 30.38 112.54 -174.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 70.7 m80 -139.2 90.96 2.47 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.91 -0.774 . . . . 28.39 108.91 174.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 58.2 t60 -108.65 98.27 7.81 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.257 0.551 . . . . 28.54 112.386 -169.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 19.8 m80 -125.14 79.44 1.8 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.741 -0.837 . . . . 26.47 108.741 167.15 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 69.43 -46.84 0.58 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 114.925 -1.034 . . . . 24.34 110.858 -171.112 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 77.8 t60 -65.78 144.33 56.94 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.186 -0.461 . . . . 23.8 110.162 177.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 66.2 m-70 -81.8 -179.97 7.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.294 -0.412 . . . . 20.9 110.363 177.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.6 m -96.49 20.54 10.48 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.767 0.794 . . . . 19.89 109.461 178.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.7 m -114.99 158.18 22.41 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.983 -1.008 . . . . 17.26 110.751 -177.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 142.0 40.08 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.732 -0.746 . . . . 16.67 112.098 -179.022 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 53.9 mtm180 -112.75 -35.98 5.32 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.699 0.761 . . . . 19.13 109.733 -179.169 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.502 ' HB2' ' HB2' ' A' ' 20' ' ' GLN . 1.6 pm0 -86.29 17.34 3.76 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.861 -1.063 . . . . 14.57 111.485 -176.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -80.41 -12.36 59.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.117 0.484 . . . . 15.4 109.883 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 55.0 mt -75.33 -26.62 58.77 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.492 -0.776 . . . . 16.35 110.624 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.479 ' HB2' ' HG2' ' A' ' 20' ' ' GLN . 93.6 m-85 -115.48 178.03 4.45 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.696 -0.684 . . . . 15.41 110.548 -176.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.0 p90 -79.93 16.19 1.25 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.115 -0.493 . . . . 11.39 110.816 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.502 ' HB2' ' HB2' ' A' ' 15' ' ' GLU . 32.5 mm-40 -55.91 -78.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.768 -0.651 . . . . 10.77 112.016 -176.5 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 52.62 33.32 41.13 Favored Glycine 0 CA--C 1.52 0.368 0 C-N-CA 120.988 -0.625 . . . . 6.73 112.018 -175.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -77.74 82.73 4.12 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.449 0.643 . . . . 6.08 112.029 -174.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 73.2 mtm -89.26 56.08 3.52 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.997 -0.547 . . . . 4.41 109.774 175.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.468 ' O ' HG23 ' A' ' 28' ' ' VAL . 41.1 t -68.73 152.17 45.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.645 -0.707 . . . . 1.71 110.032 178.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 10.3 tp -54.08 -31.15 21.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.045 -0.525 . . . . 1.37 111.244 -178.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -59.38 -52.35 65.99 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.033 -0.53 . . . . 1.75 110.449 177.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -71.92 -29.64 64.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.818 -0.628 . . . . 2.5 111.116 -177.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 24' ' ' CYS . 87.1 t -56.94 -50.21 76.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.838 0.351 . . . . 1.04 110.392 177.397 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.699 HG23 ' HG3' ' A' ' 83' ' ' GLU . 1.7 mp -66.68 -39.85 84.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.972 -0.558 . . . . 0.79 110.546 177.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.475 ' CD ' ' H3 ' ' A' ' 1' ' ' MET . 1.1 tm-20 -59.14 -52.19 66.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.95 -0.568 . . . . 2.2 110.89 -177.316 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -67.24 -36.55 81.88 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.108 0.48 . . . . 1.67 110.494 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 53.4 tttm -64.46 -52.57 57.32 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.592 -0.731 . . . . 2.03 111.592 -176.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.435 HD12 ' N ' ' A' ' 34' ' ' SER . 4.6 pp -71.51 -28.45 63.91 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.753 -0.379 . . . . 0.57 110.549 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.435 ' N ' HD12 ' A' ' 33' ' ' LEU . 39.4 t -63.74 -45.2 90.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.094 0.473 . . . . 1.29 110.024 177.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.0 m -62.16 -27.41 68.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.789 -0.641 . . . . 0.78 111.926 -178.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -93.35 -54.67 3.59 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.031 0.382 . . . . 0.64 112.031 -177.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 96.5 mt -72.47 -30.83 64.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.373 -0.376 . . . . 0.94 111.335 -175.15 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm 61.12 68.07 1.31 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.871 -0.604 . . . . 3.36 111.45 -178.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.515 ' HD2' ' OG ' ' A' ' 4' ' ' SER . 72.6 Cg_endo -90.32 126.92 1.36 Allowed 'Trans proline' 0 N--CA 1.447 -1.245 0 C-N-CA 122.549 2.166 . . . . 0.63 111.824 173.575 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.9 p -64.53 -26.36 68.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.301 0.572 . . . . 0.73 110.191 177.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.541 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 77.9 t80 -141.78 140.22 32.98 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.373 -0.83 . . . . 0.76 109.319 173.687 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -142.15 108.76 5.35 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.898 -0.778 . . . . 1.55 108.898 179.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.554 ' HB3' ' HB ' ' A' ' 58' ' ' VAL . 27.1 tt0 -100.14 140.36 34.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.402 -0.363 . . . . 2.23 110.104 -178.637 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -107.45 120.39 42.05 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.09 0.472 . . . . 1.72 110.862 -179.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 40.8 t -109.85 125.56 67.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 108.864 -0.791 . . . . 1.08 108.864 172.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -69.92 113.52 7.22 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.002 0.429 . . . . 1.83 109.908 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.432 ' O ' ' HB2' ' A' ' 54' ' ' SER . 0.7 OUTLIER -91.85 78.94 5.35 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.109 -0.496 . . . . 2.76 110.394 -176.368 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 38.6 m -68.94 90.45 0.44 Allowed 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.56 -0.533 . . . . 3.2 109.56 174.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 9.6 t -99.4 3.1 45.73 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.991 -0.55 . . . . 4.74 110.414 -176.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 79.92 -51.15 4.03 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.99 -0.624 . . . . 3.16 113.055 175.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 34.2 m -54.9 -57.78 10.24 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 122.414 0.286 . . . . 4.36 110.955 -178.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -164.96 -177.11 37.24 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 121.008 -0.615 . . . . 2.26 111.592 -179.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.3 t -56.94 122.26 11.86 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.713 0.768 . . . . 3.46 111.121 -178.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.432 ' HB2' ' O ' ' A' ' 47' ' ' LYS . 14.6 m -142.09 151.83 42.71 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.517 -0.765 . . . . 1.71 109.808 -178.361 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -135.14 141.37 45.95 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.654 -0.248 . . . . 1.15 110.502 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.68 108.44 17.49 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.455 -0.943 . . . . 1.35 108.455 174.492 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.78 118.54 36.84 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.996 0.427 . . . . 0.51 111.525 -173.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.554 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 32.2 t -83.59 112.5 21.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.538 -0.541 . . . . 0.55 109.538 177.582 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.507 HG12 ' HA ' ' A' ' 94' ' ' CYS . 2.8 pt -96.87 145.29 9.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.178 0.513 . . . . 1.18 110.675 -177.156 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.541 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 60.8 t -137.86 97.56 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 N-CA-C 108.028 -1.101 . . . . 0.58 108.028 174.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.445 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 40.8 t -144.61 150.66 37.81 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.04 0.756 . . . . 0.84 113.04 -170.825 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.689 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 7.7 m-20 -67.22 -19.19 65.5 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 114.818 -1.083 . . . . 1.67 110.886 172.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -55.55 -32.93 63.38 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.291 0.478 . . . . 1.81 112.291 -172.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -104.35 -3.07 24.62 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.191 0.441 . . . . 3.19 112.191 -173.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.689 ' HG2' ' O ' ' A' ' 62' ' ' ASN . 9.6 pt-20 -76.73 0.4 20.61 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.906 -0.496 . . . . 2.14 111.15 -177.511 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.445 ' OD2' ' HG3' ' A' ' 68' ' ' LYS . 26.6 t70 -88.98 -8.71 53.59 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.064 0.459 . . . . 2.03 110.061 177.146 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt 77.32 -13.82 0.91 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 115.244 -0.889 . . . . 3.31 112.887 174.504 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.445 ' HG3' ' OD2' ' A' ' 66' ' ' ASP . 29.9 mtmm -72.28 111.85 7.85 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.961 0.41 . . . . 1.99 110.971 176.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.4 pp -73.87 -31.41 63.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.796 -0.638 . . . . 2.33 111.738 -176.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.429 HD22 ' C ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -65.9 -31.1 71.85 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.677 -0.409 . . . . 1.09 111.335 -175.002 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.545 ' O ' ' HG2' ' A' ' 74' ' ' ARG . 1.5 t70 -73.88 -37.13 64.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.248 0.547 . . . . 2.08 109.969 -178.305 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.3 tmm_? -63.66 -44.14 94.66 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.967 -0.753 . . . . 2.93 108.967 174.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 21.1 t60 -61.48 -50.25 73.51 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.243 -0.889 . . . . 1.21 111.272 -178.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.545 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 9.3 ptm180 -62.0 -38.6 89.26 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.5 -0.318 . . . . 1.67 111.192 -177.244 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -67.4 -54.18 22.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.973 0.416 . . . . 1.48 110.633 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.86 HG13 HD22 ' A' ' 80' ' ' LEU . 65.2 t -58.86 -48.67 85.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.062 -0.517 . . . . 0.82 111.237 -177.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.497 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 5.8 m-20 -59.37 -48.23 82.42 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 121.161 -0.216 . . . . 1.14 111.464 -177.176 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 58.7 m -62.45 -54.77 35.23 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.813 0.671 . . . . 0.69 112.813 -173.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.639 HG22 ' OE2' ' A' ' 83' ' ' GLU . 5.1 mp -85.08 -48.38 16.44 Favored 'Isoleucine or valine' 0 C--O 1.247 0.947 0 CA-C-O 121.545 0.688 . . . . 0.77 111.103 -174.609 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.86 HD22 HG13 ' A' ' 76' ' ' VAL . 8.1 mp -68.51 -10.32 54.85 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.972 -0.558 . . . . 0.78 110.752 -177.151 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.497 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 20.7 tptm -52.01 -58.44 6.52 Favored 'General case' 0 C--N 1.333 -0.112 0 N-CA-C 109.493 -0.558 . . . . 1.93 109.493 165.439 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.572 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 39.5 mt-10 -60.8 -36.43 79.02 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.331 -0.85 . . . . 2.91 110.72 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.699 ' HG3' HG23 ' A' ' 29' ' ' ILE . 0.0 OUTLIER -52.76 -55.6 21.69 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 122.178 0.99 . . . . 1.66 110.381 173.254 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.757 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 54.6 mt -50.25 -30.6 12.09 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 113.061 -1.881 . . . . 0.58 112.691 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.572 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 20.7 mm-40 -61.64 -25.6 67.47 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 120.909 0.385 . . . . 0.92 110.736 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -98.35 -29.85 12.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.003 -0.544 . . . . 1.02 111.133 -176.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.488 HD12 ' HB2' ' A' ' 90' ' ' PHE . 2.7 mt -94.95 170.86 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 109.649 -0.5 . . . . 0.77 109.649 -178.546 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -94.63 -59.34 1.95 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.199 -0.667 . . . . 1.85 109.199 169.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -133.71 111.27 10.43 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.765 -0.652 . . . . 0.78 110.312 178.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' PHE . . . . . 0.488 ' HB2' HD12 ' A' ' 87' ' ' ILE . 90.2 t80 -95.21 122.51 37.97 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.112 0.482 . . . . 0.63 110.278 177.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 41.6 t -111.07 151.71 27.75 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.721 -0.672 . . . . 1.27 109.381 178.041 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -140.27 145.29 37.11 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.913 0.387 . . . . 0.64 110.849 -177.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.5 ' HG3' HG22 ' A' ' 58' ' ' VAL . 61.9 mmtt -105.89 113.87 27.68 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.325 -0.991 . . . . 2.23 108.325 173.223 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.507 ' HA ' HG12 ' A' ' 59' ' ' ILE . 5.5 p -83.39 110.35 18.08 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.093 0.473 . . . . 1.38 111.087 -176.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -135.86 160.29 39.04 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.433 0.635 . . . . 1.98 111.254 178.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.4 p -120.23 156.45 54.99 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.398 -0.819 . . . . 0.76 110.724 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -56.52 -52.12 7.71 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 123.259 2.639 . . . . 0.72 114.393 -170.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -61.19 -47.37 86.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.79 0.328 . . . . 2.08 111.398 -173.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 53.6 mp0 -68.14 -42.67 79.76 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.163 -0.471 . . . . 2.69 111.105 -178.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -63.95 -33.42 75.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 1.46 111.498 -176.405 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -62.8 -33.14 74.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.96 0.41 . . . . 1.23 111.147 -178.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.668 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -75.17 -20.63 59.24 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.438 -0.346 . . . . 2.66 110.684 179.478 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 83.5 mt -74.83 -53.04 9.83 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.84 -0.43 . . . . 1.31 109.84 175.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 7.6 ptmt -68.64 -8.31 41.07 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.875 -0.602 . . . . 1.84 111.472 179.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 47.8 t -56.81 -33.75 67.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.029 -0.532 . . . . 2.05 110.824 177.191 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.403 ' HG2' ' N ' ' A' ' 107' ' ' GLY . 0.0 OUTLIER -132.92 -45.99 0.86 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.034 0.445 . . . . 4.02 110.7 177.83 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.403 ' N ' ' HG2' ' A' ' 106' ' ' LYS . . . 153.86 -42.63 0.62 Allowed Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 111.386 -0.686 . . . . 3.92 111.386 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.449 -0.786 . . . . 4.98 109.302 177.675 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.4 mtt . . . . . 0 N--CA 1.481 1.105 0 CA-C-O 120.731 0.301 . . . . 36.14 110.382 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 141.33 -170.05 24.83 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 111.296 -0.721 . . . . 33.7 111.296 -178.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 70.4 m -71.84 -52.24 18.43 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.955 0.378 . . . . 32.35 110.589 176.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 44.7 t -177.84 111.92 0.07 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.964 -0.562 . . . . 30.38 109.498 178.232 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.414 ' N ' ' HB3' ' A' ' 46' ' ' ASP . 78.6 m-70 -79.63 95.61 5.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.307 0.575 . . . . 28.39 111.267 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 45.0 m80 -84.92 110.21 18.7 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.744 -0.836 . . . . 28.54 108.744 175.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.3 p-80 -125.96 93.69 3.9 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.703 0.763 . . . . 26.47 111.259 -179.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 27.5 p80 -87.17 144.94 26.61 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.457 -0.792 . . . . 24.34 110.175 178.512 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 29.8 p-80 -159.32 176.22 12.42 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.135 -0.484 . . . . 23.8 110.195 -178.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -81.1 154.64 26.68 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.2 -0.667 . . . . 20.9 109.2 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.4 p -62.11 137.79 58.3 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.878 0.37 . . . . 19.89 111.495 -176.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.9 m -70.53 93.39 0.9 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.421 0.629 . . . . 17.26 110.678 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -137.66 44.12 1.15 Allowed Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 111.032 -0.827 . . . . 16.67 111.032 177.588 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' A' ' 14' ' ' ARG . 11.3 ptm180 -129.41 -44.02 1.26 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.471 -0.364 . . . . 19.13 111.245 -177.227 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -102.97 4.77 37.79 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.218 0.532 . . . . 14.57 109.971 178.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.545 ' HB2' ' OG ' ' A' ' 35' ' ' SER . 27.8 p-10 -59.32 -7.43 1.29 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 114.877 -1.056 . . . . 15.4 112.987 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.8 mp -82.08 -13.44 57.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.089 0.471 . . . . 16.35 110.203 175.465 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -123.93 98.05 5.63 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.133 -0.485 . . . . 15.41 110.173 -175.311 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -73.79 7.86 2.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.077 -0.51 . . . . 11.39 111.507 -176.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -89.32 16.37 7.55 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.076 -0.511 . . . . 10.77 111.037 178.164 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.7 65.22 2.16 Favored Glycine 0 C--N 1.332 0.341 0 CA-C-N 116.157 -0.474 . . . . 6.73 113.045 -176.382 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -83.32 28.77 0.52 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.233 0.54 . . . . 6.08 110.493 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 49.1 ttm -55.95 -38.76 70.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.129 -0.941 . . . . 4.41 110.609 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.447 ' O ' HG23 ' A' ' 28' ' ' VAL . 43.0 t -163.78 146.48 9.66 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.916 -0.772 . . . . 1.71 108.916 177.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.408 ' O ' HD13 ' A' ' 29' ' ' ILE . 7.2 tp -55.85 -43.93 76.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 120.624 0.249 . . . . 1.37 110.872 178.618 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -66.06 -35.68 81.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.97 0.414 . . . . 1.75 110.412 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -61.8 -39.32 91.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.819 -0.628 . . . . 2.5 110.432 179.186 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 24' ' ' CYS . 65.3 t -60.82 -49.5 84.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.91 -0.586 . . . . 1.04 110.254 178.164 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.442 HG13 ' CD ' ' A' ' 83' ' ' GLU . 1.7 mp -57.4 -49.75 79.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 116.089 -0.505 . . . . 0.79 110.62 178.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 81.9 mt-10 -58.77 -51.97 67.69 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.231 -0.441 . . . . 2.2 112.099 -176.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.425 ' OD1' ' HA ' ' A' ' 16' ' ' ASN . 16.1 t70 -70.16 -34.1 72.58 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.804 0.335 . . . . 1.67 110.815 -174.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.404 ' HD2' ' OE2' ' A' ' 83' ' ' GLU . 37.6 ttmt -61.82 -48.86 78.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.269 -0.423 . . . . 2.03 110.934 -178.799 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.6 pp -73.51 -26.22 60.79 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.887 -0.325 . . . . 0.57 110.629 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.432 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 67.0 m -72.37 -34.56 68.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.508 -0.314 . . . . 1.29 110.628 178.175 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.545 ' OG ' ' HB2' ' A' ' 16' ' ' ASN . 67.2 m -67.16 -27.43 67.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.15 0.5 . . . . 0.78 111.021 176.326 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.34 -54.82 3.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.095 -0.502 . . . . 0.64 111.843 -176.587 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.427 HD11 HG22 ' A' ' 76' ' ' VAL . 80.1 mt -84.06 -29.71 26.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.469 -0.332 . . . . 0.94 111.023 -175.637 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.3 tptm 55.84 78.38 0.38 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 115.454 -0.794 . . . . 3.36 111.216 -176.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.495 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 83.6 Cg_endo -87.97 173.56 4.95 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 122.67 2.247 . . . . 0.63 112.45 178.349 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.9 p -106.66 -27.61 10.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.141 0.496 . . . . 0.73 110.287 175.099 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.51 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 86.2 t80 -136.63 138.57 41.3 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.825 -0.625 . . . . 0.76 109.886 177.067 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 41.5 tp -142.21 116.45 9.5 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.255 -0.43 . . . . 1.55 110.418 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -125.58 109.53 12.76 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.4 -0.364 . . . . 2.23 110.674 178.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.671 ' HG ' ' HB2' ' A' ' 57' ' ' ALA . 9.1 mp -94.87 123.58 38.42 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.394 -0.595 . . . . 1.72 109.394 173.056 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 86.1 t -103.33 133.2 47.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 115.974 -0.557 . . . . 1.08 110.489 -176.393 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.414 ' HB3' ' N ' ' A' ' 5' ' ' HIS . 3.3 t0 -64.11 110.08 2.05 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.711 -0.677 . . . . 1.83 109.595 174.491 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.915 ' HD2' ' HB2' ' A' ' 56' ' ' ASP . 79.3 tttt -112.64 48.24 1.02 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.105 -0.952 . . . . 2.76 109.706 -173.662 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 72.6 m -67.01 83.88 0.12 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.688 -0.687 . . . . 3.2 111.063 177.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 20.1 t -79.35 94.19 5.46 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.296 -0.631 . . . . 4.74 109.296 178.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 70.28 -114.27 5.37 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.774 -0.727 . . . . 3.16 111.379 -173.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 66.8 m -113.8 107.48 15.78 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.256 -0.276 . . . . 4.36 110.256 179.034 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 160.29 137.26 2.18 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.896 -0.668 . . . . 2.26 112.204 179.44 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 13.7 m -83.77 99.02 10.02 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.037 0.446 . . . . 3.46 110.759 179.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.504 ' HB3' ' HB3' ' A' ' 89' ' ' ALA . 1.7 p -134.98 151.03 50.46 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.143 -0.48 . . . . 1.71 110.696 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -134.53 144.38 47.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.939 0.399 . . . . 1.15 111.372 -177.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.915 ' HB2' ' HD2' ' A' ' 47' ' ' LYS . 5.5 t70 -115.88 114.15 24.3 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.386 -0.968 . . . . 1.35 108.386 174.777 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.671 ' HB2' ' HG ' ' A' ' 44' ' ' LEU . . . -110.63 126.54 54.59 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.436 0.532 . . . . 0.51 112.436 -171.734 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.4 t -93.08 119.84 41.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.601 -0.727 . . . . 0.55 109.67 175.162 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.465 HD11 ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER -109.87 122.24 64.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 121.244 0.545 . . . . 1.18 110.471 -178.56 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.51 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 89.8 t -114.45 107.82 23.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.596 -0.729 . . . . 0.58 109.92 178.209 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.495 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 30.5 t -151.02 154.93 37.98 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.948 0.404 . . . . 0.84 111.693 -174.338 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.41 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 3.7 m-20 -67.25 -18.86 65.4 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.744 -0.662 . . . . 1.67 110.569 173.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -53.31 -24.19 11.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.258 -0.428 . . . . 1.81 111.892 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -103.23 -8.31 20.49 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 111.994 0.368 . . . . 3.19 111.994 -177.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.413 ' HB3' HG21 ' A' ' 96' ' ' THR . 0.0 OUTLIER -72.91 -14.31 61.44 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.96 -0.463 . . . . 2.14 110.988 -174.693 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -78.36 0.57 25.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.104 -0.498 . . . . 2.03 110.545 -176.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 84.9 tttt 71.73 2.09 4.15 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.705 -0.679 . . . . 3.31 111.174 176.684 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -80.28 89.62 5.51 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.046 0.45 . . . . 1.99 110.272 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.8 tt -70.91 -49.03 50.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.857 -0.611 . . . . 2.33 109.732 -179.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.515 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -60.85 -33.25 72.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.85 -0.613 . . . . 1.09 111.628 -179.557 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.515 ' N ' HD22 ' A' ' 70' ' ' LEU . 35.8 t70 -74.07 -48.06 32.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.931 0.396 . . . . 2.08 110.293 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.15 -36.28 74.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.243 0.544 . . . . 2.93 109.636 176.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 48.8 t60 -64.21 -54.8 27.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.505 -0.77 . . . . 1.21 110.774 178.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.438 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 15.5 ptm180 -64.98 -40.39 94.91 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.004 0.372 . . . . 1.67 112.004 -175.433 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 60.2 mt -60.22 -53.34 58.91 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.922 0.392 . . . . 1.48 110.787 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.427 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 78.6 t -61.17 -43.59 96.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.922 -0.581 . . . . 0.82 110.626 179.589 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.502 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 5.5 m-20 -64.17 -35.88 82.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.279 -0.418 . . . . 1.14 112.078 -177.365 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 88.6 m -71.92 -44.39 63.72 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.775 0.322 . . . . 0.69 111.335 -176.186 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.1 mt -76.84 -50.86 20.21 Favored 'Isoleucine or valine' 0 C--O 1.244 0.811 0 CA-C-O 121.769 0.795 . . . . 0.77 110.612 -178.545 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.775 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 10.5 mp -74.14 -9.29 58.47 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.356 -0.838 . . . . 0.78 111.418 -176.38 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 16.2 tttm -53.88 -61.93 1.98 Allowed 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 109.778 -0.453 . . . . 1.93 109.778 172.071 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.409 ' OE2' ' HA ' ' A' ' 82' ' ' GLU . 0.4 OUTLIER -72.18 -30.07 64.61 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.689 -0.687 . . . . 2.91 110.288 -178.074 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.681 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.5 tp10 -55.88 -47.52 77.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.334 -0.848 . . . . 1.66 111.588 175.381 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.775 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 54.4 mt -49.96 -30.87 11.23 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 114.8 -1.091 . . . . 0.58 113.58 -178.259 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -55.54 -18.06 6.63 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.562 0.578 . . . . 0.92 112.562 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -87.08 -8.19 57.31 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.749 0.309 . . . . 1.02 111.228 179.188 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.488 HD12 ' HB2' ' A' ' 90' ' ' PHE . 0.4 OUTLIER -133.27 175.87 10.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.885 -0.413 . . . . 0.77 109.885 -177.588 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 14.4 p80 -116.28 -13.99 11.07 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.622 -0.431 . . . . 1.85 110.969 173.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.504 ' HB3' ' HB3' ' A' ' 54' ' ' SER . . . -162.15 105.94 1.18 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.919 0.39 . . . . 0.78 111.418 -178.447 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' PHE . . . . . 0.488 ' HB2' HD12 ' A' ' 87' ' ' ILE . 91.2 t80 -132.17 122.04 24.66 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.919 -0.582 . . . . 0.63 110.046 175.477 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.4 p -116.54 144.8 43.9 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.712 0.291 . . . . 1.27 110.721 179.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -123.38 145.95 48.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.945 0.402 . . . . 0.64 111.102 -178.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 26.4 mmtp -125.66 120.23 30.17 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.877 -0.786 . . . . 2.23 108.877 177.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.407 ' HA ' HG23 ' A' ' 59' ' ' ILE . 5.9 p -101.25 135.47 42.67 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.487 0.551 . . . . 1.38 112.487 -172.32 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 8.5 m80 -147.74 172.61 13.82 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.536 -0.756 . . . . 1.98 109.473 174.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.413 HG21 ' HB3' ' A' ' 65' ' ' GLU . 0.3 OUTLIER -111.04 158.67 35.19 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-O 121.014 0.435 . . . . 0.76 111.843 -177.925 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.487 ' HA ' ' HB3' ' A' ' 100' ' ' TYR . 26.1 Cg_exo -62.25 -18.36 61.99 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.201 2.601 . . . . 0.72 112.353 -177.549 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -59.63 -51.23 70.69 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.895 -0.593 . . . . 2.08 109.989 174.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -60.97 -44.81 96.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.109 0.481 . . . . 2.69 110.153 175.106 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.487 ' HB3' ' HA ' ' A' ' 97' ' ' PRO . 74.1 t80 -57.6 -41.24 80.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.367 -0.833 . . . . 1.46 111.486 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -58.87 -39.47 81.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.421 -0.354 . . . . 1.23 111.646 -178.035 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.694 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.8 OUTLIER -65.4 -37.68 87.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.817 0.341 . . . . 2.66 110.222 179.363 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.578 ' HA ' ' HA2' ' A' ' 107' ' ' GLY . 69.8 mt -65.24 -49.86 68.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.703 -0.68 . . . . 1.31 111.114 -179.025 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -35.28 78.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.469 -0.332 . . . . 1.84 111.298 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 31.1 t -63.74 -50.54 68.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.691 0.281 . . . . 2.05 110.608 -178.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.13 -43.77 0.1 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.053 0.454 . . . . 4.02 110.676 178.002 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.578 ' HA2' ' HA ' ' A' ' 103' ' ' LEU . . . 138.92 -35.51 1.98 Allowed Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.639 -0.71 . . . . 3.92 111.575 178.862 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.9 t . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.494 -0.765 . . . . 4.98 110.159 -179.067 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.8 ttp . . . . . 0 N--CA 1.478 0.948 0 CA-C-O 120.866 0.365 . . . . 36.14 110.401 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -171.65 -134.08 1.73 Allowed Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 121.055 -0.593 . . . . 33.7 111.846 178.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.9 m -110.32 153.53 24.76 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.744 0.307 . . . . 32.35 110.211 178.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.8 m -141.06 95.83 2.9 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.882 -0.414 . . . . 30.38 109.882 177.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -75.15 98.3 3.68 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.213 -0.662 . . . . 28.39 109.213 178.138 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.5 p-80 -78.44 132.0 37.12 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.1 -0.5 . . . . 28.54 111.857 -173.45 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.7 p-80 -114.32 143.03 45.54 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.577 -0.738 . . . . 26.47 109.304 177.009 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -170.3 118.33 0.55 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.641 0.258 . . . . 24.34 110.496 175.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 26.0 p80 -153.17 123.72 7.21 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.125 0.488 . . . . 23.8 110.819 174.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 17.9 t60 -88.01 95.35 10.1 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.487 -0.931 . . . . 20.9 108.487 173.62 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.5 m -126.28 118.65 25.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.097 -0.501 . . . . 19.89 111.057 -172.24 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.9 p -120.53 110.76 16.85 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.21 -0.45 . . . . 17.26 110.605 179.138 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 130.78 74.62 0.13 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.586 -0.816 . . . . 16.67 112.84 178.666 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.02 -17.93 3.82 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.98 0.419 . . . . 19.13 111.389 177.773 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -87.49 7.11 30.82 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.529 -0.305 . . . . 14.57 111.451 -175.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -73.93 -12.78 60.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.929 0.395 . . . . 15.4 110.718 -178.013 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.2 mp -75.88 -14.65 60.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.063 -0.517 . . . . 16.35 110.69 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -100.9 125.4 47.45 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.18 -0.464 . . . . 15.41 110.029 -177.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.9 p90 -98.07 15.78 23.16 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.285 -0.416 . . . . 11.39 111.051 -175.402 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 65.32 35.72 7.4 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.905 -0.589 . . . . 10.77 110.349 179.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -58.46 -45.36 94.54 Favored Glycine 0 C--N 1.334 0.435 0 CA-C-N 115.631 -0.713 . . . . 6.73 112.432 -179.36 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -138.34 98.61 3.64 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.48 0.657 . . . . 6.08 110.246 177.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 81.4 mmm -109.69 -45.92 3.59 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.93 -0.577 . . . . 4.41 109.479 178.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 51.8 t -159.86 134.07 7.48 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.388 -0.824 . . . . 1.71 109.512 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.517 HD11 ' HB3' ' A' ' 86' ' ' ASN . 9.6 tp -61.41 -32.88 54.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.832 0.349 . . . . 1.37 110.899 -179.097 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -63.67 -38.9 92.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.266 -0.425 . . . . 1.75 110.186 178.005 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -67.16 -34.11 76.86 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.981 -0.554 . . . . 2.5 110.694 177.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 71.3 t -59.0 -55.35 24.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.716 0.293 . . . . 1.04 110.619 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.478 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 2.0 mp -63.91 -44.63 98.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.982 -0.554 . . . . 0.79 110.455 178.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.456 ' O ' ' HB2' ' A' ' 34' ' ' SER . 21.0 tt0 -52.4 -51.12 60.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.849 -0.614 . . . . 2.2 110.904 179.332 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -71.81 -38.07 70.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.446 -0.797 . . . . 1.67 111.344 -173.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -60.19 -55.96 27.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.322 -0.399 . . . . 2.03 111.583 -176.556 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 3.7 pp -74.1 -25.32 59.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.671 -0.241 . . . . 0.57 111.508 -178.799 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.456 ' HB2' ' O ' ' A' ' 30' ' ' GLU . 8.0 t -68.65 -36.76 79.0 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 121.044 -0.262 . . . . 1.29 110.652 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.1 m -70.43 -27.49 64.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.762 0.315 . . . . 0.78 110.946 178.274 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.429 ' CB ' HG12 ' A' ' 79' ' ' ILE . . . -85.25 -54.88 4.33 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.067 0.395 . . . . 0.64 112.067 -176.061 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.5 mt -85.09 -34.84 22.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.647 0.26 . . . . 0.94 110.839 -176.608 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.5 ttmt 58.92 84.78 0.2 Allowed Pre-proline 0 C--O 1.234 0.26 0 CA-C-N 115.391 -0.822 . . . . 3.36 111.727 178.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.755 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 93.8 Cg_endo -93.77 161.27 2.28 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 123.073 2.516 . . . . 0.63 112.72 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 32.7 p -89.4 -21.1 23.22 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.695 0.76 . . . . 0.73 109.177 173.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.625 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 89.9 t80 -141.39 132.07 25.63 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.053 -0.976 . . . . 0.76 109.47 175.079 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.5 tp -140.67 127.69 20.74 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.268 -0.423 . . . . 1.55 110.249 -179.049 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -139.14 124.11 18.82 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.959 0.409 . . . . 2.23 110.609 177.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.8 mp -95.84 117.27 30.25 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.934 -0.575 . . . . 1.72 109.509 175.418 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 31.6 t -103.12 130.64 52.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.684 -0.689 . . . . 1.08 110.262 -176.02 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -79.34 101.42 8.08 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.819 -0.437 . . . . 1.83 109.819 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.412 ' HG3' ' HB2' ' A' ' 56' ' ' ASP . 11.4 mmmm -92.49 59.22 3.33 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.316 0.579 . . . . 2.76 110.354 -175.053 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.621 ' HA ' ' O ' ' A' ' 51' ' ' CYS . 3.0 p -80.65 16.26 1.45 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.516 -0.766 . . . . 3.2 111.914 -177.279 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 53.1 t -59.31 -42.27 91.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.08 -0.509 . . . . 4.74 110.673 177.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -146.09 19.54 1.75 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.626 -0.797 . . . . 3.16 112.187 179.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.621 ' O ' ' HA ' ' A' ' 48' ' ' SER . 75.3 m -148.78 152.79 37.17 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 110.31 -0.256 . . . . 4.36 110.31 -178.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -120.77 152.74 16.78 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.87 -0.681 . . . . 2.26 111.504 176.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.3 p 48.98 43.52 21.99 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.167 0.587 . . . . 3.46 111.658 -179.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.4 m -146.39 136.79 23.87 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.631 -0.713 . . . . 1.71 109.834 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -121.64 161.56 22.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.995 0.426 . . . . 1.15 111.312 -174.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.425 ' HA ' ' O ' ' A' ' 91' ' ' SER . 12.7 t70 -118.15 127.23 53.57 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.252 -1.018 . . . . 1.35 108.252 171.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.91 115.8 30.85 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.138 0.494 . . . . 0.51 111.602 -174.122 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.3 t -81.76 111.15 17.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.652 -0.704 . . . . 0.55 109.194 174.436 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.479 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -106.56 114.34 45.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.188 0.518 . . . . 1.18 110.049 -178.494 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.625 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 97.1 t -110.02 103.86 16.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.814 -0.63 . . . . 0.58 109.976 178.054 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.755 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 46.2 t -154.55 149.38 26.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.152 0.501 . . . . 0.84 111.171 -177.179 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.563 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 14.1 m120 -67.3 -18.64 65.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.451 -0.795 . . . . 1.67 111.176 176.035 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -47.97 -24.45 1.06 Allowed 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 112.369 0.507 . . . . 1.81 112.369 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.51 ' HD1' ' HB2' ' A' ' 68' ' ' LYS . 76.9 m-85 -118.6 16.05 13.68 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 112.196 0.443 . . . . 3.19 112.196 -178.806 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.563 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 1.0 OUTLIER -68.82 -15.85 63.62 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 120.795 0.331 . . . . 2.14 111.734 -176.153 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.593 ' HB3' ' HD3' ' A' ' 68' ' ' LYS . 31.0 t70 -84.37 15.6 3.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.252 0.548 . . . . 2.03 110.118 179.557 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.415 ' NZ ' ' HB2' ' A' ' 67' ' ' LYS . 10.6 mtmp? 57.62 51.02 10.03 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.616 -0.72 . . . . 3.31 109.845 -175.845 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.914 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 31.2 mmmt -76.91 89.03 3.48 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.871 -0.604 . . . . 1.99 110.436 -176.149 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.7 tt -73.66 -55.01 6.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.294 0.568 . . . . 2.33 109.681 177.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.493 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.5 -31.43 71.56 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.418 -0.81 . . . . 1.09 110.796 -178.341 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.914 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 25.5 t70 -73.68 -35.71 65.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.901 0.382 . . . . 2.08 110.306 -178.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -39.4 93.55 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.317 -0.623 . . . . 2.93 109.317 174.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 39.6 t60 -65.51 -51.35 60.6 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.895 -0.593 . . . . 1.21 110.64 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.544 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 3.8 ptm180 -66.54 -48.19 70.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.311 -0.404 . . . . 1.67 111.81 -176.121 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -61.39 -45.03 96.06 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.57 0.224 . . . . 1.48 111.446 -177.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.755 HG13 HD22 ' A' ' 80' ' ' LEU . 41.9 t -59.99 -42.57 90.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.427 -0.351 . . . . 0.82 110.732 178.18 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -65.62 -43.6 89.06 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.947 -0.301 . . . . 1.14 111.181 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 45.1 m -61.82 -55.92 24.93 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.988 0.366 . . . . 0.69 111.988 -177.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.429 HG12 ' CB ' ' A' ' 36' ' ' ALA . 4.2 mp -78.5 -48.6 22.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 120.819 0.342 . . . . 0.77 111.416 -176.628 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.774 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.7 mp -73.48 -6.68 47.92 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 116.509 -0.314 . . . . 0.78 111.741 -173.616 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -49.75 -54.59 18.09 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.335 -0.617 . . . . 1.93 109.335 167.484 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.428 ' O ' ' HG2' ' A' ' 85' ' ' GLN . 36.6 tt0 -75.19 -40.27 59.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.467 -0.788 . . . . 2.91 110.713 178.334 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.774 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.8 tp10 -53.71 -51.34 63.58 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.456 -0.793 . . . . 1.66 112.025 -177.679 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.687 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 67.3 mt -50.31 -30.71 12.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.204 -0.907 . . . . 0.58 112.614 -177.089 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.428 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 17.6 mm-40 -52.24 -26.53 12.03 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 111.886 0.328 . . . . 0.92 111.886 -176.518 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.517 ' HB3' HD11 ' A' ' 25' ' ' ILE . 29.8 m-80 -100.23 1.49 41.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.872 0.367 . . . . 1.02 111.209 -177.231 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.456 HD11 ' HG3' ' A' ' 83' ' ' GLU . 0.5 OUTLIER -130.56 175.9 9.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 110.007 -0.368 . . . . 0.77 110.007 -175.552 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 56.1 m-70 -123.16 -73.85 0.63 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.314 0.578 . . . . 1.85 110.008 176.01 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -104.91 57.72 0.69 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.406 -0.816 . . . . 0.78 110.505 -175.423 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -75.19 145.27 42.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.984 -0.553 . . . . 0.63 110.887 -177.666 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.425 ' O ' ' HA ' ' A' ' 56' ' ' ASP . 40.1 t -140.32 167.62 21.72 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.927 -0.579 . . . . 1.27 109.513 178.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -148.58 149.88 32.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.713 0.292 . . . . 0.64 110.707 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -125.03 109.85 13.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.183 -0.462 . . . . 2.23 110.044 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.423 ' HA ' HG23 ' A' ' 59' ' ' ILE . 4.1 p -83.41 126.91 33.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.23 0.538 . . . . 1.38 111.713 -176.287 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.452 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 45.9 m80 -142.07 162.94 34.22 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.556 -0.747 . . . . 1.98 110.038 178.274 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.5 p -112.56 154.61 44.6 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 116.524 -0.307 . . . . 0.76 110.963 176.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -59.1 -26.69 82.62 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 123.031 2.487 . . . . 0.72 112.522 -178.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -61.2 -46.43 90.48 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.872 -0.604 . . . . 2.08 110.173 177.087 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -71.57 -41.07 69.49 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.802 -0.635 . . . . 2.69 110.706 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -56.73 -40.94 76.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.906 -0.588 . . . . 1.46 111.614 -178.424 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -58.1 -35.89 72.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.85 0.357 . . . . 1.23 111.043 -178.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.692 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -74.18 -32.58 63.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.802 0.334 . . . . 2.66 110.288 179.04 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 85.8 mt -69.05 -52.12 31.89 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.323 -0.399 . . . . 1.31 110.54 179.173 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -68.32 -14.12 62.76 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.051 -0.522 . . . . 1.84 111.598 -178.804 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 4.9 t -59.58 -34.06 72.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.064 0.459 . . . . 2.05 109.951 179.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.79 -42.55 3.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.071 -0.513 . . . . 4.02 110.8 175.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 107.51 38.58 2.06 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.969 -0.634 . . . . 3.92 111.631 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 42.2 p . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.859 -0.591 . . . . 4.98 110.092 -178.744 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.6 mtp . . . . . 0 N--CA 1.482 1.161 0 N-CA-C 110.185 -0.302 . . . . 36.14 110.185 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -161.91 148.34 15.61 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.576 -0.821 . . . . 33.7 112.789 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.0 t -131.11 98.93 4.71 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.321 -0.622 . . . . 32.35 109.321 175.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 41.2 m -67.53 135.81 53.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.011 -0.54 . . . . 30.38 111.79 -174.402 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 31.94 45.98 0.05 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.351 1.46 . . . . 28.39 114.233 178.309 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.5 t-80 -95.83 4.93 52.42 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.938 0.399 . . . . 28.54 110.599 -178.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -105.13 22.67 14.93 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.993 0.425 . . . . 26.47 110.574 178.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.7 m170 -117.14 127.48 54.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.308 -0.405 . . . . 24.34 110.683 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 63.6 t-80 -176.16 118.82 0.14 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.851 -0.613 . . . . 23.8 109.481 177.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -156.94 171.77 19.86 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.818 0.342 . . . . 20.9 110.866 177.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.5 m -77.39 159.19 29.65 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.784 -0.644 . . . . 19.89 109.682 175.34 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.2 m 61.93 95.35 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.215 0.531 . . . . 17.26 111.381 -178.176 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -131.78 -61.09 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.905 -0.664 . . . . 16.67 112.88 -177.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.689 ' HD3' ' H ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -126.92 -8.92 6.03 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.174 0.512 . . . . 19.13 111.15 -174.847 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.798 ' HG3' ' HA ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -104.58 -16.87 14.9 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.682 -0.69 . . . . 14.57 110.246 -175.887 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 21.3 p-10 -66.94 5.08 0.71 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.56 -0.746 . . . . 15.4 112.478 -179.067 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.6 mp -68.05 -26.59 65.94 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 109.799 -0.445 . . . . 16.35 109.799 174.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -83.87 89.05 7.14 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.845 -0.798 . . . . 15.41 108.845 174.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.467 ' CE2' ' HA3' ' A' ' 21' ' ' GLY . 21.6 p90 -94.23 19.44 9.38 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.912 -1.04 . . . . 11.39 111.552 -171.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.551 ' HG3' ' OE1' ' A' ' 30' ' ' GLU . 2.6 mp0 70.9 19.0 5.91 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.508 0.505 . . . . 10.77 111.209 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.467 ' HA3' ' CE2' ' A' ' 19' ' ' PHE . . . -90.97 -70.16 1.2 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.43 -0.89 . . . . 6.73 113.244 -177.018 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 28.9 t60 -68.43 133.95 49.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.7 0.286 . . . . 6.08 110.893 -176.281 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.6 ttt -56.16 122.77 12.47 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.827 -0.624 . . . . 4.41 110.909 177.373 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.4 t -149.66 160.9 43.13 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.47 -0.567 . . . . 1.71 109.47 -177.796 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.505 HD11 ' HB3' ' A' ' 86' ' ' ASN . 8.6 tp -56.87 -35.82 47.92 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-O 120.886 0.374 . . . . 1.37 110.291 176.409 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -58.4 -45.98 87.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.832 -0.622 . . . . 1.75 110.527 176.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.817 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -57.66 -42.85 84.33 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.85 -0.614 . . . . 2.5 110.627 -178.869 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.526 ' O ' ' HG2' ' A' ' 32' ' ' LYS . 60.4 t -58.82 -49.98 81.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-N 116.023 -0.535 . . . . 1.04 110.711 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.551 HD11 ' HB2' ' A' ' 86' ' ' ASN . 1.7 mp -58.8 -46.01 91.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.895 -0.593 . . . . 0.79 110.243 178.095 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.551 ' OE1' ' HG3' ' A' ' 20' ' ' GLN . 62.2 mt-10 -53.33 -50.42 65.03 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.106 -0.497 . . . . 2.2 111.037 177.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -60.03 -33.88 72.62 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.227 -0.442 . . . . 1.67 111.853 -176.544 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.526 ' HG2' ' O ' ' A' ' 28' ' ' VAL . 14.8 mmmm -71.27 -55.65 7.63 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.858 -0.337 . . . . 2.03 111.091 -178.105 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.496 HD12 ' N ' ' A' ' 34' ' ' SER . 4.1 pp -69.43 -28.55 66.23 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.9 0.333 . . . . 0.57 111.9 -176.755 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.496 ' N ' HD12 ' A' ' 33' ' ' LEU . 52.5 p -72.1 -33.29 67.74 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.876 -0.33 . . . . 1.29 110.884 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 52.3 m -68.14 -34.84 77.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.916 0.388 . . . . 0.78 110.755 178.016 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.28 -54.56 4.24 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.243 0.46 . . . . 0.64 112.243 -175.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.3 mt -81.6 -23.85 36.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.396 -0.365 . . . . 0.94 110.805 -175.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.401 ' HA ' ' O ' ' A' ' 34' ' ' SER . 64.3 mttp 49.28 69.19 2.84 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 115.579 -0.737 . . . . 3.36 112.193 -179.473 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.508 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 71.5 Cg_endo -80.85 134.53 9.62 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.039 1.826 . . . . 0.63 112.034 176.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 20.8 p -67.02 -30.72 70.88 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.091 0.472 . . . . 0.73 110.045 177.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.585 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 81.3 t80 -140.43 139.16 35.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.811 -0.632 . . . . 0.76 109.851 176.144 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 60.9 tp -135.1 121.69 20.69 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.339 -0.391 . . . . 1.55 110.131 178.518 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.404 ' HB3' ' HB ' ' A' ' 58' ' ' VAL . 43.3 tt0 -119.49 115.74 24.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.982 0.42 . . . . 2.23 110.517 179.33 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -91.26 115.64 28.19 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.06 -0.518 . . . . 1.72 109.735 178.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.798 ' HA ' ' HG3' ' A' ' 15' ' ' GLU . 40.4 t -114.41 142.44 27.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.498 0.666 . . . . 1.08 110.676 -178.219 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.56 123.92 23.53 Favored 'General case' 0 N--CA 1.438 -1.041 0 CA-C-N 114.957 -1.019 . . . . 1.83 108.836 178.583 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.404 ' HD3' ' HB2' ' A' ' 54' ' ' SER . 45.4 tttp -69.1 113.57 6.59 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.929 -0.578 . . . . 2.76 111.335 -169.346 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.3 m -60.21 114.94 3.15 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.291 -0.868 . . . . 3.2 111.428 -178.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 86.5 m 68.16 23.42 7.94 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.259 -0.882 . . . . 4.74 111.402 177.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -71.72 122.73 9.44 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.473 -0.87 . . . . 3.16 111.423 175.206 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 62.7 m -73.25 92.82 1.81 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.043 0.449 . . . . 4.36 110.71 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 105.32 177.68 24.21 Favored Glycine 0 N--CA 1.443 -0.868 0 N-CA-C 111.462 -0.655 . . . . 2.26 111.462 -177.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.552 ' O ' ' HB3' ' A' ' 88' ' ' HIS . 28.3 m -64.33 98.02 0.22 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.356 0.598 . . . . 3.46 110.299 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.509 ' HB3' ' HB3' ' A' ' 89' ' ' ALA . 4.2 p -128.14 138.82 52.66 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.64 -0.709 . . . . 1.71 110.571 -176.371 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -113.12 132.53 55.41 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.115 -0.493 . . . . 1.15 110.03 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -114.82 109.5 18.26 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.342 -0.984 . . . . 1.35 108.342 175.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.99 120.06 40.79 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.256 0.55 . . . . 0.51 111.832 -170.253 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.404 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 59.0 t -79.26 114.21 19.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 115.35 -0.841 . . . . 0.55 109.016 173.541 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.487 ' CG1' ' HA ' ' A' ' 94' ' ' CYS . 1.2 pp -96.73 136.19 28.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.719 -0.475 . . . . 1.18 109.719 -177.498 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.585 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 90.0 t -130.81 97.9 3.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 108.772 -0.825 . . . . 0.58 108.772 176.778 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.508 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 40.8 t -145.39 150.92 37.43 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.291 0.567 . . . . 0.84 111.977 -173.151 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.691 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 90.5 m-20 -67.96 -19.15 64.93 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.354 -0.839 . . . . 1.67 110.178 172.029 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -62.57 -9.07 7.6 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.013 0.435 . . . . 1.81 111.325 -178.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -116.34 -11.83 11.18 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.125 0.417 . . . . 3.19 112.125 -177.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.691 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -74.01 -13.73 60.91 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.382 0.512 . . . . 2.14 112.382 -171.473 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.444 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . 7.7 t70 -91.55 10.95 25.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.006 0.431 . . . . 2.03 110.059 178.268 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.49 ' HE3' ' HB2' ' A' ' 67' ' ' LYS . 24.9 ttmt 65.97 39.05 4.66 Favored 'General case' 0 C--N 1.338 0.105 0 CA-C-N 115.627 -0.715 . . . . 3.31 109.392 176.473 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.642 ' HB3' ' HB2' ' A' ' 71' ' ' ASP . 64.4 mmtt -78.93 101.29 7.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.2 -0.909 . . . . 1.99 112.469 -173.846 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 28.9 tp -73.81 -59.74 2.58 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.026 -0.534 . . . . 2.33 110.146 171.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.431 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.82 -34.12 76.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.756 -0.657 . . . . 1.09 111.821 -170.895 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.642 ' HB2' ' HB3' ' A' ' 68' ' ' LYS . 27.1 m-20 -73.86 -43.55 58.27 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.699 0.259 . . . . 2.08 111.699 -176.343 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 34.9 ptt180 -64.6 -35.37 80.78 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.079 -0.648 . . . . 2.93 109.586 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -65.13 -52.99 51.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.874 -0.603 . . . . 1.21 110.498 179.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.505 ' CD ' ' HA ' ' A' ' 71' ' ' ASP . 5.8 ptm180 -64.6 -43.46 93.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.254 -0.43 . . . . 1.67 111.296 -175.392 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.421 HD12 ' HG3' ' A' ' 74' ' ' ARG . 8.4 mp -65.56 -48.47 72.3 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.552 0.215 . . . . 1.48 110.961 -178.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.765 HG13 HD22 ' A' ' 80' ' ' LEU . 38.2 t -59.86 -43.88 93.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.554 -0.294 . . . . 0.82 110.866 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -62.76 -46.83 86.22 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.868 -0.333 . . . . 1.14 111.04 -178.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 63.0 m -61.42 -55.94 25.77 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.17 0.433 . . . . 0.69 112.17 -177.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.0 mp -75.29 -50.25 24.94 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 120.968 0.413 . . . . 0.77 111.208 -175.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.972 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.5 mp -71.74 -5.5 34.47 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 116.371 -0.377 . . . . 0.78 111.279 -177.072 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -49.92 -63.97 0.95 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.065 0.46 . . . . 1.93 109.834 170.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.428 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 5.4 pt-20 -75.39 -31.43 60.45 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.156 -0.474 . . . . 2.91 110.929 177.309 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.972 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 34.0 tt0 -58.48 -43.96 89.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.543 -0.299 . . . . 1.66 111.127 -177.222 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.76 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 69.3 mt -57.54 -30.6 65.33 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.127 -0.488 . . . . 0.58 111.671 179.435 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.428 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 24.4 mm-40 -59.54 -17.93 36.39 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.848 0.356 . . . . 0.92 111.121 -177.202 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.551 ' HB2' HD11 ' A' ' 29' ' ' ILE . 23.4 m-80 -102.44 3.05 37.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.428 -0.351 . . . . 1.02 110.957 -177.007 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.497 HG21 ' HB2' ' A' ' 90' ' ' PHE . 8.9 mt -124.12 147.67 28.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.645 0.259 . . . . 0.77 110.564 -175.343 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.552 ' HB3' ' O ' ' A' ' 53' ' ' THR . 59.0 t60 -78.97 -45.18 20.88 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.811 -0.44 . . . . 1.85 109.811 175.153 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.509 ' HB3' ' HB3' ' A' ' 54' ' ' SER . . . -158.92 106.16 1.81 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 0.78 110.504 178.446 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' PHE . . . . . 0.497 ' HB2' HG21 ' A' ' 87' ' ' ILE . 76.2 t80 -103.35 138.02 40.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.259 -0.428 . . . . 0.63 110.357 177.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 50.7 m -140.26 145.14 36.94 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.668 -0.493 . . . . 1.27 109.668 175.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -123.35 151.79 42.16 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.168 0.508 . . . . 0.64 111.637 -175.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.0 mmtm -117.38 118.28 31.8 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.437 -0.801 . . . . 2.23 108.957 173.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.487 ' HA ' ' CG1' ' A' ' 59' ' ' ILE . 80.8 m -83.78 117.23 23.13 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.137 0.494 . . . . 1.38 111.605 -171.143 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 70.2 m80 -140.33 161.22 38.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.958 -0.565 . . . . 1.98 110.332 176.169 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.653 ' HB ' ' HD2' ' A' ' 97' ' ' PRO . 31.0 p -110.63 168.25 7.88 Favored Pre-proline 0 C--N 1.32 -0.676 0 N-CA-C 109.209 -0.664 . . . . 0.76 109.209 174.642 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.653 ' HD2' ' HB ' ' A' ' 96' ' ' THR . 12.1 Cg_endo -58.29 -28.53 84.88 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.092 1.861 . . . . 0.72 111.456 174.128 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.404 ' H ' HD22 ' A' ' 98' ' ' LEU . 2.6 mm? -72.92 -51.44 18.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 2.08 109.883 178.822 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.578 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 1.5 mp0 -58.54 -50.99 71.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.008 -0.542 . . . . 2.69 111.133 179.357 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -65.21 -43.39 91.71 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.742 0.275 . . . . 1.46 111.742 -175.244 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.484 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 33.3 t70 -62.99 -33.31 75.14 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.988 0.423 . . . . 1.23 110.769 -177.53 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.606 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.3 OUTLIER -78.41 -15.53 58.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.486 -0.325 . . . . 2.66 111.173 179.024 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 93.6 mt -76.49 -51.69 11.26 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.087 0.47 . . . . 1.31 109.947 175.365 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.484 ' HG3' ' O ' ' A' ' 101' ' ' ASP . 5.2 ptmt -65.53 -8.62 20.59 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.653 -0.703 . . . . 1.84 111.137 177.22 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.7 t -72.35 -17.39 61.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.039 -0.528 . . . . 2.05 110.555 178.589 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.38 -147.28 0.28 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.779 -0.452 . . . . 4.02 109.779 174.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -99.36 52.85 1.05 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.995 -0.621 . . . . 3.92 112.338 -175.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 51.1 m . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.212 -0.899 . . . . 4.98 110.208 177.316 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.7 ptp . . . . . 0 N--CA 1.48 1.045 0 CA-C-O 120.879 0.371 . . . . 36.14 110.562 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -101.74 102.81 2.41 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.962 -0.637 . . . . 33.7 111.574 175.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.8 m -85.61 150.9 24.31 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.708 0.29 . . . . 32.35 110.401 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.2 m -81.83 37.63 0.48 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.266 -0.424 . . . . 30.38 111.208 -177.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -57.53 107.55 0.45 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.062 -0.517 . . . . 28.39 110.61 -179.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 74.6 t60 66.38 4.87 3.42 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.547 -0.751 . . . . 28.54 111.583 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -93.05 23.13 4.46 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.659 0.742 . . . . 26.47 109.512 -178.065 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -148.07 175.0 11.37 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.657 -0.701 . . . . 24.34 109.595 -178.251 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 7.4 t-160 -88.8 136.69 32.87 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.129 -0.323 . . . . 23.8 110.129 -178.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 44.2 t-80 -93.11 146.64 23.5 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.425 -0.352 . . . . 20.9 110.679 -175.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.1 m 76.34 -50.11 0.59 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.679 0.792 . . . . 19.89 112.649 174.027 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.6 m -88.88 17.43 5.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.195 0.521 . . . . 17.26 110.895 -178.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.539 ' HA2' ' ND2' ' A' ' 16' ' ' ASN . . . -83.66 43.27 3.14 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.792 -0.64 . . . . 16.67 111.791 -175.15 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.565 ' HB2' HD23 ' A' ' 44' ' ' LEU . 14.9 ptp180 -118.84 -32.94 4.36 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.287 0.565 . . . . 19.13 109.658 -178.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -100.47 -3.46 30.8 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.488 -0.778 . . . . 14.57 111.505 -174.264 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.539 ' ND2' ' HA2' ' A' ' 13' ' ' GLY . 24.5 p30 -72.35 -0.55 12.66 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.207 0.447 . . . . 15.4 112.207 -174.163 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.0 mp -82.88 -16.13 48.76 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.132 -0.321 . . . . 16.35 110.132 176.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -127.88 168.43 15.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.407 -0.36 . . . . 15.41 111.072 -175.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 35.7 p90 -94.76 10.82 33.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.111 -0.495 . . . . 11.39 111.784 -177.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 73.47 -53.57 0.69 Allowed 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 113.356 0.873 . . . . 10.77 113.356 173.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -73.34 63.6 1.76 Allowed Glycine 0 CA--C 1.523 0.536 0 N-CA-C 114.664 0.626 . . . . 6.73 114.664 -170.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -171.72 157.58 4.68 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.799 -0.815 . . . . 6.08 108.799 177.066 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 82.8 mtp -73.56 80.41 1.48 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.361 0.601 . . . . 4.41 110.31 177.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.8 m -91.13 124.36 35.29 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.281 -0.872 . . . . 1.71 110.004 -179.029 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.492 ' O ' HD13 ' A' ' 29' ' ' ILE . 0.0 OUTLIER -57.18 -35.51 48.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.233 -0.439 . . . . 1.37 110.049 179.672 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.526 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 6.9 tp-100 -57.35 -53.78 54.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.9 -0.591 . . . . 1.75 110.924 177.341 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.9 tptp -63.88 -40.78 97.32 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.894 -0.594 . . . . 2.5 111.04 -173.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 66.6 t -60.55 -46.94 94.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.208 -0.451 . . . . 1.04 111.041 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.538 ' HA ' ' OE2' ' A' ' 83' ' ' GLU . 1.5 mp -58.84 -47.08 90.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.932 -0.576 . . . . 0.79 110.398 179.036 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.526 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 74.8 mt-10 -56.03 -52.0 65.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 2.2 111.003 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -63.34 -36.82 84.96 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.833 0.679 . . . . 1.67 112.833 -172.001 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -72.57 -47.87 44.58 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.53 -0.468 . . . . 2.03 111.61 -177.044 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.481 HD12 ' N ' ' A' ' 34' ' ' SER . 4.6 pp -74.26 -31.41 62.55 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 120.581 -0.448 . . . . 0.57 111.722 -179.197 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.481 ' N ' HD12 ' A' ' 33' ' ' LEU . 66.4 m -68.69 -33.58 74.21 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 121.151 -0.22 . . . . 1.29 111.4 -178.195 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.5 m -67.85 -27.33 66.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.95 0.405 . . . . 0.78 110.812 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.95 -52.74 4.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 0.64 111.767 -177.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 73.2 mt -85.0 -33.06 22.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.532 -0.304 . . . . 0.94 111.738 -173.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm 55.48 75.2 0.62 Allowed Pre-proline 0 N--CA 1.466 0.364 0 CA-C-N 116.045 -0.525 . . . . 3.36 112.173 -178.031 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.526 ' HB3' HG12 ' A' ' 59' ' ' ILE . 72.4 Cg_endo -82.7 133.77 7.13 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.408 2.072 . . . . 0.63 111.989 175.498 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 37.7 p -73.09 -30.53 63.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.578 0.704 . . . . 0.73 109.753 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -141.88 132.55 25.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.111 -0.95 . . . . 0.76 109.328 176.544 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.43 HD12 ' HG3' ' A' ' 39' ' ' PRO . 1.1 tt -142.24 118.95 11.08 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.196 -0.668 . . . . 1.55 109.196 179.772 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -116.96 120.51 38.63 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.89 0.376 . . . . 2.23 110.348 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.565 HD23 ' HB2' ' A' ' 14' ' ' ARG . 4.3 mm? -87.86 121.24 30.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.853 -0.612 . . . . 1.72 110.212 178.154 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 40.9 t -109.35 122.11 63.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.215 -0.448 . . . . 1.08 110.339 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -67.92 102.52 1.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.4 -0.593 . . . . 1.83 109.4 176.312 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.519 ' HD2' ' HB2' ' A' ' 56' ' ' ASP . 51.8 tttm -88.42 44.62 1.21 Allowed 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.362 -0.606 . . . . 2.76 109.362 -178.47 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.6 m 65.56 75.69 0.34 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-N 114.986 -1.007 . . . . 3.2 110.107 -176.015 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.1 p -53.7 -60.08 3.77 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.423 -0.808 . . . . 4.74 110.769 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 55.59 -131.12 49.09 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 116.091 -0.504 . . . . 3.16 113.085 175.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 34.1 m -85.39 22.34 1.54 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.017 0.437 . . . . 4.36 110.875 -178.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 99.14 63.73 0.84 Allowed Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.92 -0.657 . . . . 2.26 111.695 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.0 m -92.89 -87.65 0.23 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.573 0.225 . . . . 3.46 111.367 -179.16 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.9 m -154.58 155.81 35.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.834 0.35 . . . . 1.71 110.987 -175.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -125.28 136.17 53.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.945 -0.57 . . . . 1.15 109.6 173.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.519 ' HB2' ' HD2' ' A' ' 47' ' ' LYS . 19.3 t70 -113.24 122.39 47.31 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.89 -0.411 . . . . 1.35 109.89 -177.809 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -118.77 122.27 42.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.773 0.321 . . . . 0.51 111.606 -175.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 58.3 t -86.86 111.23 21.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 109.552 -0.536 . . . . 0.55 109.552 176.179 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.526 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -110.01 116.31 51.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.485 0.659 . . . . 1.18 110.627 -176.521 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.653 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 41.8 t -108.09 114.06 45.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.356 -0.838 . . . . 0.58 109.382 176.812 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 87.5 p -145.66 146.38 31.28 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.245 -0.582 . . . . 0.84 112.256 -177.188 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -67.22 -22.8 65.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.462 -0.79 . . . . 1.67 110.755 172.251 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -62.59 -32.11 73.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.094 -0.503 . . . . 1.81 112.282 -172.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 31.6 m-85 -98.41 0.51 45.48 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.959 -0.297 . . . . 3.19 111.256 -178.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.08 -18.97 62.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.556 -0.293 . . . . 2.14 111.742 -173.644 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -84.46 -9.66 58.18 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.918 0.389 . . . . 2.03 110.862 -175.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt 69.12 19.57 7.94 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.884 0.698 . . . . 3.31 112.884 169.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.662 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 29.0 mmmt -75.07 110.76 9.65 Favored 'General case' 0 C--N 1.327 -0.41 0 O-C-N 121.771 -0.581 . . . . 1.99 109.627 178.666 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.498 ' HA ' ' NE ' ' A' ' 72' ' ' ARG . 3.4 pp -66.53 -48.11 70.76 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.319 0.489 . . . . 2.33 112.319 -167.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.426 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.82 -30.93 70.46 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.877 0.37 . . . . 1.09 110.767 -178.204 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.426 ' N ' HD22 ' A' ' 70' ' ' LEU . 20.4 t70 -73.32 -47.54 41.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.003 -0.544 . . . . 2.08 110.341 -175.627 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.662 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 10.9 ptt85 -66.68 -33.93 76.75 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.409 -0.36 . . . . 2.93 110.806 177.044 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -66.82 -50.29 63.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.48 -0.327 . . . . 1.21 110.739 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -65.67 -37.33 86.19 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.61 -0.268 . . . . 1.67 110.995 -176.168 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 66.9 mt -64.13 -57.85 8.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.843 0.354 . . . . 1.48 110.886 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.756 HG13 HD12 ' A' ' 80' ' ' LEU . 64.4 t -57.41 -49.99 78.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.053 -0.521 . . . . 0.82 111.541 -176.517 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.447 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 5.1 m-20 -65.69 -42.89 90.68 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.959 -0.296 . . . . 1.14 111.57 -174.447 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 85.2 m -63.24 -53.98 44.47 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.852 0.316 . . . . 0.69 111.852 -176.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.4 mp -76.95 -51.1 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.81 0.338 . . . . 0.77 111.196 -177.109 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.871 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 15.4 mt -72.06 -15.16 62.02 Favored 'General case' 0 C--O 1.214 -0.8 0 N-CA-C 113.068 0.766 . . . . 0.78 113.068 -171.205 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 31.3 tttm -65.82 -56.11 13.61 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 119.163 0.892 . . . . 1.93 109.892 175.556 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.427 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 15.0 tm-20 -58.37 -32.58 68.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.323 -0.853 . . . . 2.91 109.499 176.059 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.66 ' HG2' HD23 ' A' ' 80' ' ' LEU . 6.0 tp10 -60.48 -53.74 53.88 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 114.912 -1.04 . . . . 1.66 111.11 176.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.871 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 45.4 mt -50.33 -30.65 12.56 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 114.276 -1.329 . . . . 0.58 112.059 178.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.427 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 30.7 mm-40 -51.79 -24.83 6.52 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 111.721 0.267 . . . . 0.92 111.721 -177.805 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.53 ' HB2' HD11 ' A' ' 29' ' ' ILE . 32.5 m-80 -94.07 -6.77 44.36 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.839 0.352 . . . . 1.02 111.417 -178.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 2.7 mt -120.26 151.18 22.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 109.891 -0.411 . . . . 0.77 109.891 -174.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -75.48 -45.81 36.18 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.267 -0.573 . . . . 1.85 109.721 175.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.67 117.26 3.99 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.024 -0.534 . . . . 0.78 110.18 177.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -116.02 122.35 44.95 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.108 -0.496 . . . . 0.63 110.669 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.7 p -115.33 129.5 56.62 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.322 -0.399 . . . . 1.27 110.253 176.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -107.33 139.49 41.72 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.162 0.506 . . . . 0.64 110.591 -178.088 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -108.14 111.03 22.84 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.088 -0.708 . . . . 2.23 109.088 176.31 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 45.8 t -83.23 116.14 22.26 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.339 -0.391 . . . . 1.38 110.354 -174.201 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.653 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 59.2 t60 -130.12 138.98 50.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.478 0.656 . . . . 1.98 110.35 -178.79 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -98.2 146.36 31.4 Favored Pre-proline 0 C--N 1.318 -0.803 0 CA-C-N 115.561 -0.745 . . . . 0.76 111.383 -179.364 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.459 ' HA ' ' HB3' ' A' ' 100' ' ' TYR . 37.1 Cg_endo -67.14 -21.84 48.05 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.962 2.441 . . . . 0.72 112.808 -178.229 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -64.14 -51.29 64.59 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.045 -0.724 . . . . 2.08 109.045 177.108 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -70.76 -29.58 65.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.997 -0.547 . . . . 2.69 110.653 178.644 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.459 ' HB3' ' HA ' ' A' ' 97' ' ' PRO . 85.3 t80 -62.27 -41.05 98.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.197 -0.456 . . . . 1.46 110.662 178.14 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -60.97 -33.66 73.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 1.23 110.943 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.704 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.5 OUTLIER -71.6 -24.95 61.98 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.32 -0.4 . . . . 2.66 110.952 -179.552 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 86.1 mt -75.57 -51.79 12.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.36 -0.382 . . . . 1.31 110.25 178.605 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.4 -15.69 63.65 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.1 -0.5 . . . . 1.84 111.592 178.336 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 37.0 t -69.95 -47.63 61.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.414 -0.357 . . . . 2.05 110.478 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 42.6 pttt -101.18 -175.76 2.96 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.246 0.546 . . . . 4.02 111.322 -177.201 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -135.36 29.0 2.96 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 111.223 -0.751 . . . . 3.92 111.223 176.104 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 26.0 p . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.519 -0.753 . . . . 4.98 109.841 -178.745 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.6 mtp . . . . . 0 N--CA 1.479 1.02 0 N-CA-C 110.113 -0.328 . . . . 36.14 110.113 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -82.21 -67.61 1.49 Allowed Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.727 -0.749 . . . . 33.7 111.573 177.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.1 m -142.65 41.8 1.58 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.084 0.469 . . . . 32.35 110.301 -179.5 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.1 m -78.98 72.77 5.51 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.911 -0.586 . . . . 30.38 111.591 -176.337 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 21.2 t-160 -92.52 58.91 3.25 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 107.995 -1.113 . . . . 28.39 107.995 171.531 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.542 ' HE1' ' HB3' ' A' ' 34' ' ' SER . 78.0 t60 -67.25 -21.87 65.7 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.284 -1.325 . . . . 28.54 111.394 -173.196 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.3 t-160 -80.89 99.51 8.38 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.277 -0.638 . . . . 26.47 109.277 175.285 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 18.2 m-70 -92.72 -179.78 5.25 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.02 -0.536 . . . . 24.34 110.577 -177.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.17 79.41 1.81 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.897 -0.592 . . . . 23.8 110.203 176.841 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -81.61 67.25 7.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.539 -0.755 . . . . 20.9 109.03 178.062 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.5 t -73.25 -21.31 60.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.566 -0.743 . . . . 19.89 110.851 -173.5 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.2 p -66.56 100.59 0.68 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.916 -0.584 . . . . 17.26 110.521 176.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -91.79 -30.43 10.47 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.839 -0.619 . . . . 16.67 112.561 -176.046 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.29 -22.75 4.65 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.971 0.415 . . . . 19.13 110.957 -179.364 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -97.76 13.85 28.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.233 -0.44 . . . . 14.57 111.459 -176.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -81.65 1.34 34.48 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.906 0.384 . . . . 15.4 110.866 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -94.66 5.83 50.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.992 -0.549 . . . . 16.35 110.299 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -120.38 -175.79 3.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.171 0.51 . . . . 15.41 111.583 -177.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.7 p90 -89.66 18.09 5.83 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.197 -0.91 . . . . 11.39 110.617 -179.051 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -59.85 100.55 0.09 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.519 -0.764 . . . . 10.77 111.072 178.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.88 89.37 2.1 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.643 -0.789 . . . . 6.73 112.583 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -73.49 112.66 9.77 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.43 -0.582 . . . . 6.08 109.43 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 63.7 mtt -119.05 163.34 17.14 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.818 0.342 . . . . 4.41 111.341 -176.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 43.4 t -70.96 148.35 47.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.587 -0.733 . . . . 1.71 110.725 177.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.4 tp -52.5 -39.45 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 115.669 -0.696 . . . . 1.37 111.75 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -64.83 -39.32 93.38 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.199 0.523 . . . . 1.75 110.914 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.416 ' HB2' ' HE3' ' A' ' 27' ' ' LYS . 39.3 ttmt -70.34 -40.02 74.36 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.513 -0.767 . . . . 2.5 110.658 -177.075 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.3 t -66.21 -46.38 87.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.899 -0.591 . . . . 1.04 111.082 -178.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.58 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.5 mp -59.49 -49.3 84.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.79 111.44 -178.626 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.418 ' HG3' HD21 ' A' ' 44' ' ' LEU . 1.3 tm-20 -61.17 -39.14 89.01 Favored 'General case' 0 C--O 1.226 -0.177 0 N-CA-C 110.244 -0.28 . . . . 2.2 110.244 -177.768 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -64.2 -44.24 92.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.528 -0.305 . . . . 1.67 111.079 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -70.53 -55.48 8.79 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 112.343 0.498 . . . . 2.03 112.343 -173.657 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 3.3 pp -68.69 -29.3 67.72 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.433 -0.507 . . . . 0.57 111.498 -175.628 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.542 ' HB3' ' HE1' ' A' ' 6' ' ' HIS . 55.0 m -73.4 -35.67 65.91 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.794 -0.362 . . . . 1.29 111.349 177.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.9 m -67.0 -27.46 67.44 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.851 -0.34 . . . . 0.78 111.092 176.46 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -92.38 -54.9 3.61 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 112.431 0.53 . . . . 0.64 112.431 -176.163 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.7 mt -79.46 -26.6 41.68 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.832 0.349 . . . . 0.94 110.673 -177.315 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 65.1 mttm 59.3 72.92 0.74 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.278 -0.874 . . . . 3.36 112.671 176.188 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.449 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 84.6 Cg_endo -91.29 165.71 3.62 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 122.876 2.384 . . . . 0.63 111.635 172.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 28.6 p -94.22 -32.27 13.75 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.038 0.446 . . . . 0.73 110.258 178.233 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.708 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 82.8 t80 -133.05 134.37 44.28 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.776 -0.647 . . . . 0.76 109.867 178.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -142.29 113.31 7.53 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.563 -0.532 . . . . 1.55 109.563 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -111.56 134.69 52.96 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.953 -0.388 . . . . 2.23 109.953 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.418 HD21 ' HG3' ' A' ' 30' ' ' GLU . 3.5 mm? -110.92 124.9 53.02 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.782 0.325 . . . . 1.72 110.944 -178.505 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 48.3 t -127.84 133.9 66.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.056 -0.52 . . . . 1.08 109.692 175.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.408 ' HA ' ' O ' ' A' ' 54' ' ' SER . 5.6 t70 -75.03 134.0 41.51 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 120.91 0.386 . . . . 1.83 110.164 175.685 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -93.36 -10.46 35.23 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.084 -0.507 . . . . 2.76 110.323 -178.125 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.554 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 20.1 m 62.24 28.72 17.16 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.748 -0.66 . . . . 3.2 111.516 178.769 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 47.4 t -78.55 105.23 9.68 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.714 -0.476 . . . . 4.74 109.714 178.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.32 -115.25 5.24 Favored Glycine 0 N--CA 1.445 -0.72 0 N-CA-C 111.422 -0.671 . . . . 3.16 111.422 -177.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 72.0 m -103.62 16.92 25.26 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.137 0.494 . . . . 4.36 110.697 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.554 ' HA2' ' HA ' ' A' ' 48' ' ' SER . . . 85.35 38.21 9.2 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.657 -0.783 . . . . 2.26 112.697 177.607 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.9 p -119.59 52.87 1.07 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.674 0.75 . . . . 3.46 109.841 175.051 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.408 ' O ' ' HA ' ' A' ' 46' ' ' ASP . 21.7 p -135.55 132.18 36.89 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.041 -0.982 . . . . 1.71 110.471 -175.44 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -118.8 132.43 56.13 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 121.014 -0.274 . . . . 1.15 110.86 -178.118 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -113.0 113.02 24.89 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 107.754 -1.202 . . . . 1.35 107.754 171.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.0 117.88 35.17 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.172 0.511 . . . . 0.51 112.251 -169.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 61.1 t -83.64 112.28 20.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.675 -0.693 . . . . 0.55 109.641 175.046 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.673 HG13 ' HA ' ' A' ' 94' ' ' CYS . 1.0 OUTLIER -100.53 140.02 20.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.254 -0.43 . . . . 1.18 110.502 -176.051 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.708 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 95.1 t -127.98 107.44 16.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 108.864 -0.791 . . . . 0.58 108.864 171.402 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.449 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 43.5 t -155.78 154.87 32.07 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.073 0.463 . . . . 0.84 112.028 -174.307 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.49 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 6.0 m-20 -67.07 -19.47 65.67 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 115.558 -0.747 . . . . 1.67 110.333 173.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -58.02 -30.47 66.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.608 -0.724 . . . . 1.81 111.031 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -94.73 -11.1 29.73 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.185 0.517 . . . . 3.19 110.665 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.49 ' HB3' ' HA ' ' A' ' 62' ' ' ASN . 0.6 OUTLIER -91.42 -16.13 27.83 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 108.643 -0.873 . . . . 2.14 108.643 -176.962 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -74.22 0.64 13.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.374 -0.83 . . . . 2.03 109.843 175.044 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 53.3 mmtt 64.98 37.81 6.67 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 114.837 -1.074 . . . . 3.31 110.864 175.459 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.89 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 42.3 mmtm -96.1 92.07 6.25 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.063 -0.517 . . . . 1.99 111.148 177.759 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.411 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 5.8 tt -73.64 -57.29 4.09 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.436 -0.579 . . . . 2.33 109.436 177.438 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.433 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -68.18 -32.26 72.37 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.043 -0.526 . . . . 1.09 111.448 -177.388 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.89 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 24.3 t70 -74.09 -38.65 63.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.363 -0.38 . . . . 2.08 111.431 -173.164 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.411 ' HG2' ' O ' ' A' ' 69' ' ' LEU . 50.9 ptt85 -62.63 -34.54 77.26 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.422 -0.511 . . . . 2.93 109.851 177.398 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 73.4 t60 -69.05 -46.6 67.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.271 -0.422 . . . . 1.21 110.53 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.527 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 3.7 ptm180 -68.17 -38.77 82.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.659 -0.246 . . . . 1.67 110.884 -178.377 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -65.67 -47.58 75.03 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.833 -0.167 . . . . 1.48 111.028 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.519 HG13 HD22 ' A' ' 80' ' ' LEU . 37.2 t -57.51 -45.4 85.94 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 CA-C-N 116.567 -0.288 . . . . 0.82 110.665 177.615 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.543 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 5.1 m-20 -67.35 -29.5 69.07 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.93 -0.308 . . . . 1.14 111.622 -179.031 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 91.5 m -66.25 -48.3 70.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.794 0.33 . . . . 0.69 111.019 -178.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 21.0 mt -81.8 -51.14 15.54 Favored 'Isoleucine or valine' 0 C--O 1.242 0.671 0 CA-C-O 121.952 0.882 . . . . 0.77 110.62 -177.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.954 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.3 mp -74.67 -0.13 16.97 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.195 -0.912 . . . . 0.78 111.27 -176.752 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.543 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 56.0 tptt -50.86 -63.71 1.04 Allowed 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 108.949 -0.76 . . . . 1.93 108.949 169.523 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -75.49 -35.68 60.76 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.906 -0.588 . . . . 2.91 110.968 176.662 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.954 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 30.7 tt0 -59.5 -41.18 89.29 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 111.868 0.321 . . . . 1.66 111.868 -175.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 41.0 mt -56.46 -30.68 63.2 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.185 0.439 . . . . 0.58 112.185 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -57.83 -18.23 20.97 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.72 0.295 . . . . 0.92 111.566 -174.756 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -100.27 -4.34 29.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.717 -0.22 . . . . 1.02 111.515 -177.37 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 6.1 mt -115.38 152.12 17.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 109.923 -0.399 . . . . 0.77 109.923 -177.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -84.43 -38.24 20.44 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.825 -0.435 . . . . 1.85 109.825 176.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -161.08 108.41 1.49 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.213 -0.449 . . . . 0.78 111.029 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -105.64 138.29 42.08 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.012 0.434 . . . . 0.63 110.869 176.129 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 44.5 m -134.61 158.84 43.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.872 -0.604 . . . . 1.27 109.485 175.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -137.0 147.56 46.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.22 0.533 . . . . 0.64 111.755 -176.274 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 48.7 mmtm -119.3 109.33 15.68 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.44 -0.8 . . . . 2.23 108.978 173.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.673 ' HA ' HG13 ' A' ' 59' ' ' ILE . 4.5 p -84.01 121.29 27.2 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.059 0.457 . . . . 1.38 111.315 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -131.79 153.88 49.67 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.333 0.587 . . . . 1.98 111.224 176.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 17.8 p -97.37 148.55 34.58 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.572 -0.74 . . . . 0.76 110.55 177.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -62.16 -30.25 81.86 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.621 2.214 . . . . 0.72 111.979 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.52 -51.34 60.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.667 -0.697 . . . . 2.08 109.965 -179.138 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.446 ' HA ' ' HE3' ' A' ' 102' ' ' LYS . 12.6 tp10 -72.57 -30.98 64.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.856 0.36 . . . . 2.69 110.489 -178.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -56.09 -35.21 66.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.864 -0.607 . . . . 1.46 111.595 -179.462 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.456 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 23.8 t70 -62.7 -36.57 83.37 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 121.094 -0.242 . . . . 1.23 111.031 -176.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.446 ' HE3' ' HA ' ' A' ' 99' ' ' GLU . 0.0 OUTLIER -66.62 -33.14 74.99 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.117 0.484 . . . . 2.66 110.495 178.16 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 69.1 mt -67.97 -46.59 70.94 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.903 -0.589 . . . . 1.31 110.251 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 101' ' ' ASP . 0.0 OUTLIER -75.02 -8.25 55.98 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.109 -0.496 . . . . 1.84 111.977 -179.45 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 50.2 m -59.97 -42.68 94.67 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.947 0.404 . . . . 2.05 109.986 174.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.425 ' HE3' ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -100.44 -41.18 7.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.123 -0.49 . . . . 4.02 110.26 175.191 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.85 44.57 7.66 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 121.017 -0.611 . . . . 3.92 112.661 176.654 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.0 p . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.943 -0.551 . . . . 4.98 110.877 179.271 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.6 tpt . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 120.862 0.363 . . . . 36.14 110.391 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 91.66 -138.01 14.06 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.386 -0.911 . . . . 33.7 112.368 177.634 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.505 ' HA ' ' OD2' ' A' ' 46' ' ' ASP . 74.9 m -60.3 118.2 6.13 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.699 0.761 . . . . 32.35 112.797 -174.012 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.5 m -125.39 -21.12 4.62 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.502 -1.226 . . . . 30.38 109.563 176.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -100.75 112.17 24.53 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.052 -0.522 . . . . 28.39 109.949 178.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -105.94 118.32 36.3 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.43 -0.35 . . . . 28.54 110.135 178.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 49.3 t60 -70.79 129.55 39.39 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.864 -0.421 . . . . 26.47 109.864 177.578 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 11.8 t-80 -67.93 114.96 6.92 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.507 -0.553 . . . . 24.34 109.507 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.0 t-80 -78.69 53.23 1.31 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.506 0.67 . . . . 23.8 111.296 -174.405 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -170.48 133.42 1.04 Allowed 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.636 -0.875 . . . . 20.9 108.636 176.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 63.0 m -56.55 109.85 0.69 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.172 0.51 . . . . 19.89 111.2 -179.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.2 p -134.15 48.73 2.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.514 -0.766 . . . . 17.26 110.013 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -84.8 23.78 7.34 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.508 -0.769 . . . . 16.67 112.478 -176.183 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 46.2 mtm180 -102.43 -50.69 3.53 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.738 0.78 . . . . 19.13 109.635 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -97.82 -16.56 19.77 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.762 -1.108 . . . . 14.57 112.01 -174.136 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.0 p-10 -74.0 8.74 1.87 Allowed 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.129 0.418 . . . . 15.4 112.129 -175.356 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.6 mp -82.04 -10.98 59.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.15 0.5 . . . . 16.35 110.131 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.445 ' HB3' ' HG2' ' A' ' 20' ' ' GLN . 97.5 m-85 -107.18 127.83 53.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.933 -0.576 . . . . 15.41 110.214 -179.871 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -77.14 33.19 0.15 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.029 -0.532 . . . . 11.39 111.825 -179.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.445 ' HG2' ' HB3' ' A' ' 18' ' ' TYR . 30.6 mm-40 -67.94 109.09 3.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.323 -0.399 . . . . 10.77 110.691 179.588 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -142.88 -159.72 8.06 Favored Glycine 0 N--CA 1.445 -0.722 0 C-N-CA 120.735 -0.745 . . . . 6.73 111.817 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 50.0 t60 -106.51 155.48 19.55 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.826 -0.435 . . . . 6.08 109.826 -178.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.6 mmt -58.02 100.52 0.06 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.121 0.486 . . . . 4.41 110.857 175.076 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 79.5 m -146.5 160.1 42.55 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.626 -0.715 . . . . 1.71 109.606 179.151 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.8 tp -54.8 -31.93 25.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 O-C-N 123.386 0.429 . . . . 1.37 111.414 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -58.6 -49.15 78.52 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.586 -0.279 . . . . 1.75 110.98 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.596 ' HE3' ' OE2' ' A' ' 30' ' ' GLU . 10.2 mmmm -70.91 -27.35 63.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.475 -0.33 . . . . 2.5 111.372 -177.025 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 81.8 t -58.82 -54.12 38.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.902 0.382 . . . . 1.04 110.067 176.368 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.509 HG12 HD11 ' A' ' 87' ' ' ILE . 1.8 mp -64.95 -48.78 82.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.615 -0.721 . . . . 0.79 110.509 178.336 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.596 ' OE2' ' HE3' ' A' ' 27' ' ' LYS . 27.1 tt0 -58.16 -52.21 66.5 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.966 -0.561 . . . . 2.2 111.461 -175.578 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -68.13 -31.98 71.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.542 -0.299 . . . . 1.67 111.299 -176.059 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -66.19 -55.66 15.18 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 120.588 0.233 . . . . 2.03 110.995 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 4.0 pp -72.8 -23.84 60.84 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.793 -0.363 . . . . 0.57 111.467 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.558 ' O ' ' HA ' ' A' ' 38' ' ' LYS . 22.7 t -69.08 -36.35 77.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.1 0.476 . . . . 1.29 110.131 176.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.3 m -71.68 -48.92 44.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.221 -0.445 . . . . 0.78 110.812 177.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.61 -54.76 6.84 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.614 0.598 . . . . 0.64 112.614 -173.545 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.8 mt -80.69 -33.41 35.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.937 0.398 . . . . 0.94 110.272 -177.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.558 ' HA ' ' O ' ' A' ' 34' ' ' SER . 18.7 ttmm 58.01 81.22 0.26 Allowed Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.045 -0.98 . . . . 3.36 112.154 174.801 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.697 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 5.4 Cg_endo -87.08 147.85 7.94 Favored 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 123.165 2.577 . . . . 0.63 112.197 178.321 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.22 -22.58 33.09 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.456 0.646 . . . . 0.73 109.794 176.122 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.679 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 64.4 t80 -141.63 127.6 19.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.235 -0.893 . . . . 0.76 109.156 171.164 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 48.6 tp -142.32 133.8 26.56 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.396 -0.366 . . . . 1.55 110.273 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -149.6 139.8 22.19 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.858 0.361 . . . . 2.23 110.536 174.401 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.416 HD22 ' N ' ' A' ' 44' ' ' LEU . 3.1 mm? -88.61 124.68 34.29 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.499 -0.556 . . . . 1.72 109.499 176.733 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 59.1 t -103.17 135.35 41.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.703 -0.48 . . . . 1.08 109.703 -178.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.505 ' OD2' ' HA ' ' A' ' 3' ' ' SER . 10.3 t70 -69.41 105.01 2.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.905 -1.043 . . . . 1.83 111.082 -172.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.631 ' HE2' ' HB2' ' A' ' 56' ' ' ASP . 16.0 tppt? -95.28 70.75 3.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.402 0.62 . . . . 2.76 109.705 179.344 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 29.8 t -69.64 -16.46 63.37 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.544 -0.753 . . . . 3.2 110.248 178.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 50.3 t -103.44 92.94 4.69 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.068 -0.514 . . . . 4.74 109.63 175.102 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -169.1 -141.59 3.26 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.746 -0.74 . . . . 3.16 111.852 -178.638 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 56.6 m -109.59 81.11 1.39 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.733 0.302 . . . . 4.36 110.451 -179.106 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.5 -88.12 0.52 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.176 -0.535 . . . . 2.26 112.289 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.5 m -115.65 101.79 9.16 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.256 0.551 . . . . 3.46 109.749 177.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.5 m -128.66 149.35 50.7 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.613 -0.721 . . . . 1.71 109.968 -177.557 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -136.39 143.36 43.95 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.592 -0.276 . . . . 1.15 110.481 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.631 ' HB2' ' HE2' ' A' ' 47' ' ' LYS . 38.7 t70 -122.0 115.27 22.22 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.016 -0.735 . . . . 1.35 109.016 175.798 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.03 119.42 39.14 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.026 0.441 . . . . 0.51 111.648 -171.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.514 ' HA ' ' HB2' ' A' ' 93' ' ' LYS . 62.2 t -75.71 111.25 11.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.229 -0.656 . . . . 0.55 109.229 175.223 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.521 HD11 ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER -113.67 110.53 32.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.911 0.862 . . . . 1.18 110.487 -176.782 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.679 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 98.2 t -107.81 106.44 20.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 114.747 -1.115 . . . . 0.58 108.945 175.596 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.697 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 40.4 t -151.55 155.13 37.84 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.344 0.592 . . . . 0.84 111.792 -173.118 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.526 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 6.1 m-20 -62.02 -19.23 62.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.971 -1.013 . . . . 1.67 111.66 176.269 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.439 ' OD1' ' HB3' ' A' ' 61' ' ' SER . 28.4 p-10 -63.78 -26.18 68.52 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.705 0.288 . . . . 1.81 111.285 -179.182 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.553 ' HD2' HG23 ' A' ' 96' ' ' THR . 59.6 t80 -90.63 -13.2 34.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.439 0.638 . . . . 3.19 109.674 176.586 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.526 ' HB3' ' HA ' ' A' ' 62' ' ' ASN . 0.9 OUTLIER -87.36 -11.03 50.54 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 108.878 -0.786 . . . . 2.14 108.878 -179.668 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -63.31 -19.46 64.62 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.029 -0.987 . . . . 2.03 110.451 178.335 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm 78.61 -28.28 0.16 Allowed 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.07 0.948 . . . . 3.31 111.883 176.297 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -71.24 100.03 2.02 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.929 0.395 . . . . 1.99 110.377 178.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.512 HD12 ' N ' ' A' ' 70' ' ' LEU . 4.0 pp -70.04 -36.31 74.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.277 -0.42 . . . . 2.33 111.432 -175.312 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.512 ' N ' HD12 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -67.79 -32.96 73.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.801 0.334 . . . . 1.09 110.942 178.951 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.522 ' HA ' ' HG2' ' A' ' 74' ' ' ARG . 7.2 m-20 -74.08 -37.73 64.13 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 120.888 0.375 . . . . 2.08 110.126 177.532 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -57.64 -43.3 84.77 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.377 -0.601 . . . . 2.93 109.377 172.315 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 30.7 t60 -63.42 -53.31 54.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.558 -0.746 . . . . 1.21 111.143 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.522 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 9.9 ptm180 -63.69 -36.6 84.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.3 -0.409 . . . . 1.67 111.6 -175.658 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -63.96 -49.48 72.34 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.77 0.319 . . . . 1.48 110.773 178.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 74.6 t -58.57 -42.82 85.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.069 -0.514 . . . . 0.82 110.297 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.536 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 6.2 m-20 -64.3 -35.41 80.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.297 -0.41 . . . . 1.14 111.45 179.372 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 86.8 m -62.2 -51.33 68.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.838 0.351 . . . . 0.69 111.446 -178.504 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.4 HD12 ' N ' ' A' ' 79' ' ' ILE . 2.9 mp -80.03 -48.88 19.87 Favored 'Isoleucine or valine' 0 C--O 1.241 0.617 0 CA-C-O 121.44 0.638 . . . . 0.77 110.927 -177.295 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.893 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.5 mp -74.94 -2.27 26.28 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.933 -0.576 . . . . 0.78 111.441 -175.206 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.536 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 56.9 tptt -51.6 -64.1 0.92 Allowed 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 109.497 -0.557 . . . . 1.93 109.497 171.208 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.423 ' HG3' ' N ' ' A' ' 83' ' ' GLU . 2.4 pt-20 -75.07 -33.68 61.71 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.001 -0.545 . . . . 2.91 110.867 176.319 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.893 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 5.2 tp10 -55.18 -53.6 53.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.193 0.521 . . . . 1.66 112.049 -175.767 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 70.3 mt -50.39 -30.67 12.91 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.269 -0.878 . . . . 0.58 112.472 178.717 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -57.21 -24.34 53.9 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.023 0.44 . . . . 0.92 110.733 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -91.67 -10.82 38.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.064 -0.517 . . . . 1.02 111.47 -175.349 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.509 HD11 HG12 ' A' ' 29' ' ' ILE . 3.1 mt -120.46 164.13 17.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.746 -0.464 . . . . 0.77 109.746 -176.667 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -92.24 -46.36 7.76 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.505 -0.554 . . . . 1.85 109.505 175.163 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -148.3 109.6 4.36 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.032 -0.531 . . . . 0.78 110.514 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -116.77 127.41 54.32 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.295 -0.412 . . . . 0.63 110.547 177.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 37.0 p -124.44 167.07 14.92 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.412 -0.588 . . . . 1.27 109.412 175.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -143.51 146.01 33.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.919 0.39 . . . . 0.64 111.132 -178.016 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.514 ' HB2' ' HA ' ' A' ' 58' ' ' VAL . 44.5 mmtm -97.42 109.35 22.12 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.003 -0.74 . . . . 2.23 109.003 174.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 3.9 p -89.9 111.56 22.65 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.062 -0.517 . . . . 1.38 111.018 -174.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.464 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 1.7 m80 -138.3 156.82 47.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.985 -0.552 . . . . 1.98 110.671 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.553 HG23 ' HD2' ' A' ' 64' ' ' PHE . 47.5 p -98.16 153.47 38.09 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.225 -0.443 . . . . 0.76 110.272 177.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -64.39 -22.21 66.09 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.35 2.033 . . . . 0.72 111.191 175.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.402 HD22 ' HA ' ' A' ' 98' ' ' LEU . 1.4 tm? -68.56 -44.0 75.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.262 -0.881 . . . . 2.08 109.411 177.716 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 57.0 tt0 -75.9 -35.63 59.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.473 -0.785 . . . . 2.69 110.132 178.224 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -58.43 -32.49 68.74 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.931 -0.577 . . . . 1.46 110.957 178.275 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -52.03 -36.28 49.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.11 -0.495 . . . . 1.23 111.589 177.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -77.57 -35.43 53.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.101 0.477 . . . . 2.66 110.167 178.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 66.3 mt -77.3 -24.27 50.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.748 -0.66 . . . . 1.31 111.709 -173.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.425 ' HG3' ' N ' ' A' ' 105' ' ' SER . 41.8 pttt -81.58 -32.68 32.0 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.862 -0.335 . . . . 1.84 110.485 177.828 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.425 ' N ' ' HG3' ' A' ' 104' ' ' LYS . 36.6 m -64.31 -41.97 96.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.996 -0.547 . . . . 2.05 110.009 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.474 ' C ' ' HD2' ' A' ' 106' ' ' LYS . 0.1 OUTLIER -159.43 174.16 15.12 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.698 -0.683 . . . . 4.02 110.34 174.912 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -113.8 -19.85 6.32 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.756 -0.735 . . . . 3.92 112.702 -173.459 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 56.4 m . . . . . 0 C--O 1.245 0.854 0 CA-C-O 118.343 -0.837 . . . . 4.98 110.236 -177.078 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 46.1 tpp . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 110.124 -0.324 . . . . 36.14 110.124 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.484 ' HA3' ' HG2' ' A' ' 27' ' ' LYS . . . 179.54 -32.01 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.422 -0.894 . . . . 33.7 113.047 179.268 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.611 ' HB2' ' HB3' ' A' ' 30' ' ' GLU . 32.5 t -74.38 130.15 39.12 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.993 0.425 . . . . 32.35 111.06 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.0 t -73.53 128.9 36.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.134 -0.484 . . . . 30.38 109.726 177.169 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -94.79 21.84 7.05 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.114 -0.493 . . . . 28.39 111.325 -173.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 72.1 m80 -81.88 112.73 19.27 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.973 -0.558 . . . . 28.54 109.55 174.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -74.02 82.72 1.74 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.846 -0.615 . . . . 26.47 110.986 -175.299 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.519 ' HB3' ' HB2' ' A' ' 11' ' ' SER . 91.4 m-70 -97.39 114.65 26.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.974 -0.557 . . . . 24.34 110.117 177.361 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -82.53 85.42 6.96 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.693 0.283 . . . . 23.8 110.254 178.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 70.0 t60 69.63 6.96 5.98 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.685 -0.688 . . . . 20.9 111.278 176.281 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.519 ' HB2' ' HB3' ' A' ' 8' ' ' HIS . 13.2 m -69.09 -38.45 78.98 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.035 0.445 . . . . 19.89 110.293 177.581 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 29.6 m -78.58 94.41 5.0 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.909 -0.587 . . . . 17.26 110.548 -179.466 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -168.89 40.55 0.22 Allowed Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.754 -0.736 . . . . 16.67 112.283 178.586 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.3 ptp180 -143.06 -34.35 0.43 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.759 0.314 . . . . 19.13 111.495 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.407 ' H ' ' HG2' ' A' ' 15' ' ' GLU . 10.8 pt-20 -85.2 10.74 11.49 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.071 0.463 . . . . 14.57 111.536 -175.499 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -68.16 -9.3 45.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.624 -0.717 . . . . 15.4 111.054 176.231 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.432 HD13 ' HA ' ' A' ' 17' ' ' LEU . 4.4 mm? -62.96 -28.54 70.15 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.117 0.484 . . . . 16.35 110.045 173.738 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -98.49 86.66 3.65 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.502 0.668 . . . . 15.41 109.484 174.399 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.8 p90 -96.54 11.43 35.16 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.975 -1.012 . . . . 11.39 111.16 -174.55 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 27.9 mp0 -78.03 64.95 3.33 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.06 0.457 . . . . 10.77 110.489 177.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -140.19 68.54 0.48 Allowed Glycine 0 N--CA 1.446 -0.634 0 CA-C-N 115.578 -0.737 . . . . 6.73 111.521 178.585 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -53.23 135.67 37.84 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.88 0.371 . . . . 6.08 111.064 179.647 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.549 ' SD ' ' HD2' ' A' ' 27' ' ' LYS . 24.7 ptt? -143.46 140.57 30.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.313 -0.403 . . . . 4.41 111.112 -176.46 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.444 ' O ' HG23 ' A' ' 28' ' ' VAL . 62.3 m -69.0 167.97 14.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.727 -0.67 . . . . 1.71 111.391 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.1 tp -61.64 -38.39 80.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 116.165 -0.47 . . . . 1.37 111.757 -176.242 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.2 tt0 -59.3 -43.11 92.65 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.086 0.469 . . . . 1.75 110.504 177.07 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.549 ' HD2' ' SD ' ' A' ' 23' ' ' MET . 11.7 tmtt? -64.75 -34.55 78.6 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.532 -0.758 . . . . 2.5 109.808 -179.176 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 24' ' ' CYS . 93.6 t -61.71 -43.95 97.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.993 -0.549 . . . . 1.04 110.49 176.774 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.508 HG13 ' HG3' ' A' ' 83' ' ' GLU . 1.7 mp -67.22 -42.93 88.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.17 -0.468 . . . . 0.79 110.535 178.213 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.611 ' HB3' ' HB2' ' A' ' 3' ' ' SER . 45.1 mt-10 -52.21 -50.38 62.05 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.44 -0.345 . . . . 2.2 111.036 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.465 ' HA ' ' HB3' ' A' ' 34' ' ' SER . 4.6 m-20 -78.79 -18.98 53.24 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.249 0.463 . . . . 1.67 112.249 -178.908 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.458 ' HE3' HG23 ' A' ' 79' ' ' ILE . 51.5 tptt -61.46 -55.74 27.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.804 0.335 . . . . 2.03 110.21 178.443 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.517 HD11 ' HG ' ' A' ' 42' ' ' LEU . 4.4 pp -73.68 -26.38 60.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.229 -0.442 . . . . 0.57 110.429 176.621 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.604 ' O ' ' HD2' ' A' ' 38' ' ' LYS . 4.7 t -63.7 -45.96 87.63 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 116.169 -0.468 . . . . 1.29 109.907 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.8 m -53.27 -27.89 24.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.955 0.407 . . . . 0.78 111.231 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.615 ' HB2' HG12 ' A' ' 79' ' ' ILE . . . -89.22 -43.35 11.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.937 -0.574 . . . . 0.64 112.316 -177.743 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.0 mp -107.06 -36.13 6.68 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.461 0.541 . . . . 0.94 112.461 -173.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.604 ' HD2' ' O ' ' A' ' 34' ' ' SER . 27.9 mmmt 51.01 75.3 0.67 Allowed Pre-proline 0 N--CA 1.468 0.443 0 C-N-CA 123.3 0.64 . . . . 3.36 110.845 -168.399 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -81.97 141.66 12.01 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.716 2.277 . . . . 0.63 112.391 -178.027 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.4 p -60.95 -35.05 75.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.594 -0.73 . . . . 0.73 111.182 179.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.687 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 72.4 t80 -138.36 124.09 19.82 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.477 -0.564 . . . . 0.76 109.477 175.874 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.517 ' HG ' HD11 ' A' ' 33' ' ' LEU . 3.3 tm? -142.54 122.62 13.71 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.748 -0.834 . . . . 1.55 108.748 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.527 ' O ' ' HA ' ' A' ' 57' ' ' ALA . 10.7 tp10 -143.24 140.48 30.7 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.673 -0.411 . . . . 2.23 111.039 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.481 HD13 ' HG2' ' A' ' 30' ' ' GLU . 10.6 mp -106.74 117.41 33.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.086 0.47 . . . . 1.72 110.771 178.793 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 52.9 t -106.22 119.26 55.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.73 -0.668 . . . . 1.08 109.956 176.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -73.52 122.84 22.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.998 -0.546 . . . . 1.83 110.101 177.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.7 mtmm -110.94 142.36 43.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.283 -0.417 . . . . 2.76 110.719 -177.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.6 p -80.2 90.42 5.5 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.417 -0.586 . . . . 3.2 109.417 171.138 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 30.1 t -107.32 13.1 27.44 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.033 -0.531 . . . . 4.74 110.81 -174.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 84.38 -40.02 2.93 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.889 -0.672 . . . . 3.16 112.76 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 56.0 m -78.46 38.85 0.32 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.797 0.332 . . . . 4.36 111.136 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.1 -140.08 29.29 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 121.13 -0.557 . . . . 2.26 111.878 -177.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.2 t -77.87 127.35 32.25 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.539 0.685 . . . . 3.46 110.732 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.7 p -138.03 135.53 36.0 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.712 -0.676 . . . . 1.71 109.29 177.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -111.33 132.7 54.2 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.184 0.516 . . . . 1.15 110.747 -175.086 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -112.59 118.55 35.4 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.191 -0.913 . . . . 1.35 108.589 176.464 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.527 ' HA ' ' O ' ' A' ' 43' ' ' GLU . . . -105.68 115.6 30.52 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.999 0.428 . . . . 0.51 111.68 -173.404 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.413 ' O ' ' HA ' ' A' ' 42' ' ' LEU . 47.3 t -74.43 110.93 9.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 108.589 -0.893 . . . . 0.55 108.589 172.389 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -107.65 109.68 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 CA-C-O 121.862 0.839 . . . . 1.18 109.963 -177.687 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.687 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 60.2 t -111.26 105.21 18.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 115.026 -0.988 . . . . 0.58 110.088 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 88.2 p -156.75 142.18 17.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.231 0.539 . . . . 0.84 111.238 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.644 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 61.4 m-20 -67.69 -18.49 64.94 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.372 -0.831 . . . . 1.67 112.07 177.529 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -48.99 -36.83 18.53 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.878 0.371 . . . . 1.81 111.029 177.318 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.603 ' CE1' ' HA ' ' A' ' 72' ' ' ARG . 21.3 m-30 -101.59 21.4 14.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.955 0.407 . . . . 3.19 111.286 -178.631 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.644 ' HB3' ' O ' ' A' ' 62' ' ' ASN . 0.7 OUTLIER -92.95 -14.57 27.34 Favored 'General case' 0 N--CA 1.426 -1.658 0 N-CA-C 108.407 -0.96 . . . . 2.14 108.407 178.847 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -73.21 -4.02 30.39 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.365 -0.834 . . . . 2.03 109.916 178.759 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 99.2 mttt 67.45 25.32 8.57 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.359 -0.837 . . . . 3.31 111.888 172.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.524 ' HE2' HD11 ' A' ' 70' ' ' LEU . 13.5 mmmm -93.08 96.53 10.11 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.852 -0.613 . . . . 1.99 109.896 178.172 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.471 HD12 ' N ' ' A' ' 70' ' ' LEU . 4.3 pp -72.35 -33.16 67.08 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.968 -0.293 . . . . 2.33 110.977 -175.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.524 HD11 ' HE2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -67.88 -35.16 78.02 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 120.957 -0.297 . . . . 1.09 110.682 177.662 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.521 ' N ' HD22 ' A' ' 70' ' ' LEU . 23.0 m-20 -71.66 -45.32 62.32 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 109.567 -0.531 . . . . 2.08 109.567 175.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.603 ' HA ' ' CE1' ' A' ' 64' ' ' PHE . 0.5 OUTLIER -52.88 -48.07 67.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.476 -0.784 . . . . 2.93 110.033 175.497 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.6 t60 -65.94 -53.03 44.49 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.721 -0.672 . . . . 1.21 111.315 -177.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -67.04 -41.65 86.17 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 111.961 0.356 . . . . 1.67 111.961 -172.575 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.99 -49.98 70.33 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.929 0.395 . . . . 1.48 110.315 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.776 HG13 HD22 ' A' ' 80' ' ' LEU . 35.0 t -57.74 -46.55 86.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.701 -0.681 . . . . 0.82 110.635 178.188 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -61.84 -40.24 94.62 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.611 -0.268 . . . . 1.14 111.583 -178.201 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 74.8 m -60.99 -51.22 70.17 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 111.626 0.232 . . . . 0.69 111.626 -177.324 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.615 HG12 ' HB2' ' A' ' 36' ' ' ALA . 2.7 mp -81.12 -48.84 18.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 CA-C-O 120.9 0.381 . . . . 0.77 111.295 -176.088 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.86 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.0 mp -69.8 -7.44 39.83 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 116.208 -0.451 . . . . 0.78 111.669 -176.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -55.51 -59.71 4.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.273 0.559 . . . . 1.93 109.951 171.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -68.64 -37.38 79.65 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.608 -0.724 . . . . 2.91 110.178 177.357 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.86 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 32.9 tt0 -55.27 -41.22 71.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.743 -0.662 . . . . 1.66 111.285 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.727 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 57.3 mt -54.84 -30.99 58.88 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 123.082 0.553 . . . . 0.58 112.402 179.426 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -60.2 -18.49 48.65 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.734 0.302 . . . . 0.92 111.3 -174.149 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.503 ' HB2' HD11 ' A' ' 29' ' ' ILE . 25.8 m-80 -101.8 4.86 40.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.815 0.34 . . . . 1.02 110.929 -178.476 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 3.3 mt -127.32 163.81 29.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 110.102 -0.332 . . . . 0.77 110.102 -175.344 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -96.55 -52.23 4.02 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.619 -0.511 . . . . 1.85 109.619 173.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -144.4 101.15 3.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.922 -0.581 . . . . 0.78 110.311 177.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -93.31 141.47 28.4 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.279 -0.419 . . . . 0.63 110.944 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.5 m -138.38 163.58 31.5 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.742 -0.836 . . . . 1.27 108.742 175.032 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -146.06 151.56 37.92 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.57 -0.452 . . . . 0.64 111.61 -178.718 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -113.81 116.32 29.16 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.56 -0.746 . . . . 2.23 109.481 176.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 42.5 t -84.23 124.19 30.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.71 0.29 . . . . 1.38 110.724 -177.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.666 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 2.1 t60 -147.99 152.72 37.95 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.868 -0.419 . . . . 1.98 109.868 179.122 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.489 HG21 ' HB2' ' A' ' 65' ' ' GLU . 0.8 OUTLIER -102.19 151.89 38.16 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-O 120.76 0.314 . . . . 0.76 111.838 178.113 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -59.36 -48.04 14.96 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.999 2.466 . . . . 0.72 112.247 -177.366 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.29 -36.12 81.13 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.83 -0.623 . . . . 2.08 111.199 -177.179 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.562 ' HA ' ' CE ' ' A' ' 102' ' ' LYS . 20.1 tp10 -75.72 -38.51 58.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.773 0.32 . . . . 2.69 110.627 -178.849 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -65.38 -33.25 75.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.871 0.367 . . . . 1.46 110.093 176.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -54.48 -43.75 72.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.578 -0.737 . . . . 1.23 111.591 178.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.562 ' CE ' ' HA ' ' A' ' 99' ' ' GLU . 0.0 OUTLIER -61.99 -47.78 83.29 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 120.899 -0.32 . . . . 2.66 110.708 177.72 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 62.4 mt -60.43 -46.42 90.1 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.181 -0.463 . . . . 1.31 111.309 -176.003 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -8.44 59.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.351 -0.386 . . . . 1.84 111.79 -177.486 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 35.8 t -67.04 -38.5 85.97 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.195 0.522 . . . . 2.05 110.267 179.226 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.408 ' HE3' ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -110.73 -41.55 4.26 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.856 -0.611 . . . . 4.02 110.581 178.399 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 98.88 51.06 1.42 Allowed Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.889 -0.672 . . . . 3.92 111.995 179.118 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 46.9 m . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.175 -0.917 . . . . 4.98 110.121 179.282 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 mmt . . . . . 0 N--CA 1.481 1.101 0 N-CA-C 110.09 -0.337 . . . . 36.14 110.09 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -97.28 -101.13 2.06 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.765 -0.731 . . . . 33.7 112.351 -179.059 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 47.3 m 63.96 22.23 12.9 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.279 0.562 . . . . 32.35 110.689 -178.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.1 m -88.51 114.6 25.3 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.707 -0.679 . . . . 30.38 111.575 -174.479 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 70.0 m-70 -102.15 39.69 1.45 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.108 0.48 . . . . 28.39 109.718 173.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -56.79 133.47 54.28 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.153 -0.931 . . . . 28.54 110.382 178.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -87.37 125.18 34.1 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.107 -0.497 . . . . 26.47 110.555 -178.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -107.42 107.65 18.63 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.851 -0.426 . . . . 24.34 109.851 176.389 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 41.1 p-80 -66.02 133.99 51.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.89 0.376 . . . . 23.8 110.741 178.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.6 p80 -134.41 144.62 48.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.959 -0.564 . . . . 20.9 110.132 -178.336 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.9 t -79.55 110.38 14.82 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.295 0.569 . . . . 19.89 110.954 -177.053 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.8 m -128.14 30.44 5.22 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.721 -0.672 . . . . 17.26 109.3 176.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -75.03 15.72 3.86 Favored Glycine 0 C--N 1.333 0.408 0 CA-C-N 115.593 -0.731 . . . . 16.67 114.043 -172.454 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 -90.76 -49.21 6.58 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.579 0.704 . . . . 19.13 109.94 175.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -91.15 30.2 1.28 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.015 -0.993 . . . . 14.57 111.399 -173.566 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -70.96 -15.46 62.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.272 0.558 . . . . 15.4 110.208 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 53.4 mt -82.31 -10.63 59.02 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.496 -0.775 . . . . 16.35 111.108 -177.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -98.38 156.18 16.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.918 0.389 . . . . 15.41 111.318 -175.276 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.2 p90 -116.12 -14.19 11.16 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.942 -0.572 . . . . 11.39 110.421 178.282 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 72.65 -61.66 0.49 Allowed 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.634 0.774 . . . . 10.77 112.191 177.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -150.61 -40.57 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.521 -0.847 . . . . 6.73 112.034 -178.633 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 -152.11 136.67 16.9 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.95 -0.759 . . . . 6.08 108.95 -179.122 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 66.6 mtt -64.8 107.72 1.54 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.514 -0.55 . . . . 4.41 109.514 178.377 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 34.7 m -60.78 159.74 10.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.827 -0.624 . . . . 1.71 110.814 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.3 tp -55.01 -34.15 30.89 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 CA-C-N 116.201 -0.454 . . . . 1.37 111.157 -178.453 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 21.2 tm0? -58.83 -47.4 84.94 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.593 -0.276 . . . . 1.75 110.317 177.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.573 ' HA ' ' HB3' ' A' ' 30' ' ' GLU . 53.1 mttt -71.74 -17.82 62.17 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 116.426 -0.352 . . . . 2.5 111.671 -178.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 95.3 t -67.25 -51.1 56.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 109.174 -0.676 . . . . 1.04 109.174 174.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.591 ' HA ' ' OE2' ' A' ' 83' ' ' GLU . 2.0 mp -61.29 -51.33 74.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 115.135 -0.939 . . . . 0.79 109.646 174.559 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.573 ' HB3' ' HA ' ' A' ' 27' ' ' LYS . 34.1 tt0 -53.06 -51.77 60.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.303 -0.862 . . . . 2.2 111.564 -178.197 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -61.87 -45.52 93.41 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.974 -0.557 . . . . 1.67 111.799 -174.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -68.42 -47.52 67.03 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.378 -0.529 . . . . 2.03 112.24 -175.207 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.486 HD12 ' N ' ' A' ' 34' ' ' SER . 4.2 pp -70.8 -27.69 64.08 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.095 -0.642 . . . . 0.57 110.987 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.486 ' N ' HD12 ' A' ' 33' ' ' LEU . 46.5 t -66.66 -46.34 76.03 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.937 -0.394 . . . . 1.29 109.937 175.706 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.8 m -71.35 -27.73 63.56 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.297 -0.41 . . . . 0.78 111.337 -179.201 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.61 -43.17 20.96 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.082 0.401 . . . . 0.64 112.082 -176.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 85.8 mt -104.46 -38.05 6.95 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.724 0.268 . . . . 0.94 111.724 -174.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.3 mttm 53.6 90.37 0.09 OUTLIER Pre-proline 0 N--CA 1.467 0.384 0 CA-C-O 121.647 0.737 . . . . 3.36 112.642 -175.283 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.75 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 5.2 Cg_endo -87.74 158.73 7.62 Favored 'Trans proline' 0 N--CA 1.451 -1.022 0 C-N-CA 123.155 2.57 . . . . 0.63 112.047 175.024 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 21.6 p -82.77 -26.19 32.08 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.742 0.782 . . . . 0.73 109.031 173.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.57 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 91.6 t80 -140.1 132.33 28.17 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.695 -1.139 . . . . 0.76 109.268 173.542 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.571 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 59.3 tp -136.18 122.64 20.74 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.941 -0.392 . . . . 1.55 109.941 -179.063 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.519 ' HB3' ' HB ' ' A' ' 58' ' ' VAL . 34.9 tt0 -119.88 119.86 34.75 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.432 -0.349 . . . . 2.23 110.061 -179.284 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -104.09 115.85 31.16 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.023 -0.362 . . . . 1.72 110.023 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 50.1 t -121.91 124.71 71.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.632 -0.258 . . . . 1.08 110.762 -178.277 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -82.07 122.63 28.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.113 0.482 . . . . 1.83 109.984 174.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -96.47 107.77 20.22 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.874 -0.603 . . . . 2.76 110.538 -178.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 36.4 m -79.92 27.93 0.29 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.822 -0.626 . . . . 3.2 111.408 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 17.0 t -78.57 99.15 6.4 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.039 -0.726 . . . . 4.74 109.039 178.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 109.83 -118.1 5.0 Favored Glycine 0 N--CA 1.445 -0.72 0 N-CA-C 110.913 -0.875 . . . . 3.16 110.913 -173.097 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 36.9 t -157.01 147.39 21.23 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.711 0.291 . . . . 4.36 110.478 177.214 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 104.52 -140.79 15.11 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 111.386 -0.685 . . . . 2.26 111.386 -178.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.7 t -136.82 134.47 37.0 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.386 0.612 . . . . 3.46 110.493 176.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.526 ' HB3' ' O ' ' A' ' 89' ' ' ALA . 68.6 m -146.29 135.95 23.19 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.501 -0.772 . . . . 1.71 108.969 179.675 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.463 ' HB2' ' CD1' ' A' ' 90' ' ' PHE . 81.2 m-85 -111.57 132.66 54.39 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.599 0.714 . . . . 1.15 111.385 -170.362 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -110.81 113.85 26.75 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 107.702 -1.221 . . . . 1.35 107.702 173.165 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.34 116.12 31.39 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.298 0.571 . . . . 0.51 111.382 -173.17 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.519 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 44.8 t -83.61 111.12 19.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 108.791 -0.818 . . . . 0.55 108.791 174.462 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.438 HG23 ' HA ' ' A' ' 94' ' ' CYS . 0.0 OUTLIER -110.14 107.84 23.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 121.876 0.846 . . . . 1.18 110.553 -176.207 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.57 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 94.4 t -107.72 108.01 24.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 114.86 -1.063 . . . . 0.58 109.013 176.253 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.75 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 45.2 t -151.36 154.78 37.35 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.254 0.549 . . . . 0.84 112.112 -173.175 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.491 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 91.3 m-20 -66.53 -19.44 65.78 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.233 -0.894 . . . . 1.67 110.27 174.126 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -64.69 -20.79 66.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.916 -0.584 . . . . 1.81 110.537 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -110.47 7.01 22.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.36 0.6 . . . . 3.19 110.042 178.103 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.491 ' HB3' ' O ' ' A' ' 62' ' ' ASN . 0.5 OUTLIER -76.69 -28.34 55.88 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 109.347 -0.612 . . . . 2.14 109.347 -177.008 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -71.72 -8.57 54.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.815 -0.63 . . . . 2.03 110.225 172.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 54.6 mttp 65.73 29.44 10.7 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.384 -0.826 . . . . 3.31 112.165 171.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.443 ' HB3' ' OD2' ' A' ' 71' ' ' ASP . 14.2 mmmm -90.71 96.11 10.48 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.024 0.44 . . . . 1.99 109.974 175.571 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.444 HD12 ' N ' ' A' ' 70' ' ' LEU . 3.8 pp -73.48 -36.77 65.86 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.98 -0.555 . . . . 2.33 111.521 -174.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.455 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.87 -32.26 72.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.717 0.294 . . . . 1.09 110.972 178.496 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.455 ' N ' HD22 ' A' ' 70' ' ' LEU . 4.1 m-20 -66.84 -49.39 65.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.914 0.388 . . . . 2.08 110.666 -179.533 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.43 ' HG3' ' O ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -66.08 -26.83 67.66 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.827 -0.349 . . . . 2.93 110.344 178.724 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -69.51 -50.03 49.01 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 116.278 -0.419 . . . . 1.21 111.001 -179.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 11.6 ptm180 -66.7 -36.31 82.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.66 -0.245 . . . . 1.67 111.169 -178.418 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.84 -50.59 55.83 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 120.711 0.291 . . . . 1.48 111.034 177.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.539 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 8.9 p -61.77 -35.4 67.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.298 0 CA-C-N 116.496 -0.32 . . . . 0.82 110.25 -179.087 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.601 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 5.3 m-20 -69.62 -33.66 72.96 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.625 -0.261 . . . . 1.14 110.996 177.741 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 66.8 m -59.48 -51.72 68.66 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.707 0.289 . . . . 0.69 111.344 179.564 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.0 mp -83.18 -47.55 18.2 Favored 'Isoleucine or valine' 0 C--O 1.244 0.796 0 CA-C-O 121.681 0.753 . . . . 0.77 111.149 -177.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.805 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.3 mp -77.31 -0.45 25.54 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.176 -0.466 . . . . 0.78 112.121 -173.679 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.601 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 56.9 tptt -58.68 -57.77 11.54 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.26 -0.644 . . . . 1.93 109.26 171.824 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -72.15 -34.12 68.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.3 -0.863 . . . . 2.91 109.99 177.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.805 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.7 tp10 -54.86 -51.03 67.21 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.628 -0.714 . . . . 1.66 112.468 178.543 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.732 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 52.7 mt -50.35 -30.42 12.15 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.283 -0.871 . . . . 0.58 113.252 -176.759 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -53.73 -19.63 4.43 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.269 0.47 . . . . 0.92 112.269 -174.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -101.86 -4.0 27.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.77 0.319 . . . . 1.02 111.54 -177.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.498 HD11 HG12 ' A' ' 29' ' ' ILE . 12.6 mt -114.94 151.7 16.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.482 -0.326 . . . . 0.77 110.136 -174.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -84.99 -55.23 4.16 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.804 -0.358 . . . . 1.85 110.099 177.491 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.526 ' O ' ' HB3' ' A' ' 54' ' ' SER . . . -144.16 91.22 2.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.937 0.399 . . . . 0.78 111.185 178.292 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' PHE . . . . . 0.463 ' CD1' ' HB2' ' A' ' 55' ' ' PHE . 63.7 t80 -86.4 141.41 29.18 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.323 -0.399 . . . . 0.63 110.002 177.067 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 8.8 m -141.04 158.56 43.77 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.372 -0.603 . . . . 1.27 109.372 177.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -138.65 147.14 42.51 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.932 0.396 . . . . 0.64 111.124 -179.366 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -115.97 109.54 17.71 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.664 -0.698 . . . . 2.23 109.725 175.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.438 ' HA ' HG23 ' A' ' 59' ' ' ILE . 7.9 p -85.6 123.82 31.45 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.719 0.295 . . . . 1.38 110.623 -177.707 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.485 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 3.3 m-70 -144.0 160.52 40.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.165 0.507 . . . . 1.98 110.99 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.424 ' CG2' ' HA ' ' A' ' 65' ' ' GLU . 11.5 p -102.75 153.69 38.03 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 115.489 -0.778 . . . . 0.76 111.132 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -58.12 -28.76 84.9 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.721 2.281 . . . . 0.72 111.69 175.104 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.53 -47.16 76.75 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.896 -0.593 . . . . 2.08 110.285 177.599 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -67.05 -51.82 49.82 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.629 -0.714 . . . . 2.69 110.657 179.38 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -62.11 -32.39 72.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.917 -0.583 . . . . 1.46 110.966 -176.188 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.493 ' HA ' ' HE2' ' A' ' 104' ' ' LYS . 25.7 t70 -55.42 -33.24 63.37 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.035 -0.53 . . . . 1.23 111.072 178.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.42 ' N ' ' HE3' ' A' ' 102' ' ' LYS . 0.6 OUTLIER -76.55 -43.51 38.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.971 0.415 . . . . 2.66 110.223 176.8 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 86.2 mt -65.25 -49.57 69.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.799 -0.637 . . . . 1.31 111.492 -175.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.493 ' HE2' ' HA ' ' A' ' 101' ' ' ASP . 47.8 pttt -57.52 -25.3 59.66 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.193 -0.458 . . . . 1.84 111.694 -176.346 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.493 ' HB3' ' HD2' ' A' ' 106' ' ' LYS . 44.4 t -62.68 -20.66 65.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.847 -0.615 . . . . 2.05 111.391 -175.7 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.51 ' HB3' ' HE3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -144.74 -42.44 0.24 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.831 0.308 . . . . 4.02 111.831 -179.16 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 101.58 19.14 16.56 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.961 -0.638 . . . . 3.92 111.869 -178.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 10.0 t . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.453 -0.784 . . . . 4.98 109.738 -178.037 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.9 ptm . . . . . 0 N--CA 1.48 1.05 0 CA-C-O 120.654 0.264 . . . . 36.14 110.445 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 77.93 -89.62 1.07 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 121.009 -0.615 . . . . 33.7 112.784 175.698 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -71.0 123.9 23.12 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.544 0.211 . . . . 32.35 110.616 -178.088 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.6 t -155.07 137.92 15.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.195 0.521 . . . . 30.38 111.167 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 7.7 t-160 -158.03 109.58 2.26 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 107.633 -1.247 . . . . 28.39 107.633 174.137 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.556 ' HA ' ' O ' ' A' ' 104' ' ' LYS . 93.9 m-70 -62.02 109.28 1.23 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.471 0.653 . . . . 28.54 112.156 -168.494 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.57 ' HB2' ' HB2' ' A' ' 104' ' ' LYS . 1.4 m-70 -134.42 168.49 18.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.565 -1.198 . . . . 26.47 109.678 179.626 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 15.8 p80 -116.11 177.8 4.55 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.523 -0.917 . . . . 24.34 108.523 171.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 57.8 m170 -59.86 120.9 10.47 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.269 -1.012 . . . . 23.8 108.269 174.189 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -63.5 -16.36 60.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.864 -0.607 . . . . 20.9 111.852 -166.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.9 m 64.64 30.23 12.69 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.462 0.649 . . . . 19.89 110.506 177.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.624 ' HA ' ' NH1' ' A' ' 14' ' ' ARG . 32.3 m -100.16 165.3 11.57 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.247 -0.888 . . . . 17.26 109.819 177.136 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 163.28 -15.13 0.11 Allowed Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.486 -0.864 . . . . 16.67 113.279 -178.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.624 ' NH1' ' HA ' ' A' ' 12' ' ' SER . 0.5 OUTLIER -107.88 -19.31 13.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 117.676 0.738 . . . . 19.13 111.314 -177.183 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.476 ' OE2' ' HD2' ' A' ' 14' ' ' ARG . 1.2 pm0 -87.66 13.76 9.79 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.608 -0.269 . . . . 14.57 111.602 -176.052 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -76.92 -11.04 59.76 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.368 -0.604 . . . . 15.4 109.368 174.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.7 mp -91.8 -0.95 57.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.43 -0.804 . . . . 16.35 110.031 175.323 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.441 ' HB3' HE22 ' A' ' 20' ' ' GLN . 84.4 m-85 -120.47 93.03 3.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.237 0.542 . . . . 15.41 111.521 -175.355 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.425 ' HZ ' ' HG3' ' A' ' 27' ' ' LYS . 28.0 t80 -111.34 81.32 1.42 Allowed 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.423 -0.808 . . . . 11.39 109.935 176.097 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.441 HE22 ' HB3' ' A' ' 18' ' ' TYR . 0.8 OUTLIER -141.06 132.57 26.96 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.008 -0.542 . . . . 10.77 110.671 179.019 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -176.0 -78.54 0.05 OUTLIER Glycine 0 N--CA 1.446 -0.652 0 CA-C-N 115.67 -0.695 . . . . 6.73 111.375 178.349 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -148.92 138.29 21.71 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.78 -0.452 . . . . 6.08 109.78 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 84.1 mtp -94.96 127.7 41.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.199 0.524 . . . . 4.41 110.845 -179.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.509 ' O ' HG23 ' A' ' 28' ' ' VAL . 42.4 t -155.84 150.72 26.32 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.646 -0.872 . . . . 1.71 108.646 176.405 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.552 ' O ' HG12 ' A' ' 29' ' ' ILE . 8.7 tp -53.07 -38.2 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 O-C-N 123.501 0.501 . . . . 1.37 111.626 -175.531 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -62.01 -52.26 64.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.807 0.337 . . . . 1.75 110.614 179.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.425 ' HG3' ' HZ ' ' A' ' 19' ' ' PHE . 17.4 tppt? -64.97 -31.45 72.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.101 -0.5 . . . . 2.5 110.774 -178.457 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 24' ' ' CYS . 89.5 t -61.79 -46.45 96.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 110.125 -0.324 . . . . 1.04 110.125 175.742 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.599 HG21 HD11 ' A' ' 87' ' ' ILE . 51.3 mm -63.14 -43.07 98.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.132 -0.486 . . . . 0.79 110.342 177.283 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -54.18 -51.94 62.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.982 -0.553 . . . . 2.2 111.005 177.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.418 ' HA ' ' HG ' ' A' ' 34' ' ' SER . 16.5 t70 -67.65 -34.55 77.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.183 0.516 . . . . 1.67 111.007 -179.55 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.541 ' HG2' ' OE1' ' A' ' 83' ' ' GLU . 13.5 tptp -60.18 -55.89 28.31 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.517 -0.765 . . . . 2.03 111.388 -177.423 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -74.16 -29.76 61.93 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.984 -0.286 . . . . 0.57 111.722 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.418 ' HG ' ' HA ' ' A' ' 31' ' ' ASP . 73.6 p -72.04 -33.4 67.97 Favored 'General case' 0 C--O 1.224 -0.248 0 C-N-CA 121.089 -0.244 . . . . 1.29 111.241 -177.812 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.2 m -65.79 -27.32 68.19 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.826 0.346 . . . . 0.78 111.042 176.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.29 -49.47 6.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.385 -0.37 . . . . 0.64 111.672 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.6 mt -83.11 -30.15 28.16 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.855 0.317 . . . . 0.94 111.855 -177.239 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 16.3 mmtm 55.68 81.82 0.25 Allowed Pre-proline 0 N--CA 1.466 0.329 0 C-N-CA 123.175 0.59 . . . . 3.36 112.331 -176.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.589 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 69.0 Cg_endo -92.62 139.23 1.81 Allowed 'Trans proline' 0 N--CA 1.448 -1.195 0 C-N-CA 122.887 2.392 . . . . 0.63 111.947 174.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 13.7 p -68.41 -32.5 72.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.22 0.533 . . . . 0.73 110.298 176.111 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.502 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 69.1 t80 -141.97 131.76 24.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.491 -0.777 . . . . 0.76 109.472 176.588 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.7 tp -141.87 112.87 7.41 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.756 0.312 . . . . 1.55 110.535 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -125.74 139.17 53.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.493 -0.321 . . . . 2.23 110.322 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.5 ' HG ' ' HB2' ' A' ' 57' ' ' ALA . 7.2 mp -117.12 122.41 44.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.541 -0.3 . . . . 1.72 110.497 -178.434 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.507 HG23 ' HB3' ' A' ' 56' ' ' ASP . 9.6 m -112.75 150.79 14.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.017 0.437 . . . . 1.08 111.135 178.115 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -78.28 119.58 21.84 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.793 -0.64 . . . . 1.83 110.235 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 21.5 ttmm -100.16 124.91 46.13 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.223 -0.444 . . . . 2.76 109.862 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.2 p -79.43 106.42 11.44 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.194 -0.457 . . . . 3.2 111.284 -177.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 49.7 t -113.86 15.51 18.58 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.337 0.589 . . . . 4.74 109.692 176.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 81.11 -111.63 3.33 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.831 -0.699 . . . . 3.16 111.585 -177.508 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 40.4 t -88.26 101.34 13.76 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.169 -0.678 . . . . 4.36 109.169 174.169 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 127.92 99.79 1.02 Allowed Glycine 0 N--CA 1.446 -0.683 0 N-CA-C 110.811 -0.915 . . . . 2.26 110.811 -174.154 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.1 p -78.17 99.93 6.41 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.01 0.433 . . . . 3.46 111.322 -176.21 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.0 p -87.81 144.2 26.73 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.997 -0.547 . . . . 1.71 110.711 178.298 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -111.63 132.74 54.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.415 -0.357 . . . . 1.15 110.621 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.507 ' HB3' HG23 ' A' ' 45' ' ' VAL . 5.2 t70 -107.76 110.37 22.17 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.33 -0.619 . . . . 1.35 109.33 179.08 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.5 ' HB2' ' HG ' ' A' ' 44' ' ' LEU . . . -106.17 115.8 30.84 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.99 0.424 . . . . 0.51 111.315 -177.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 56.2 t -82.02 111.18 18.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.81 -0.632 . . . . 0.55 109.32 175.427 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.431 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -104.41 108.8 25.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.667 0.746 . . . . 1.18 110.13 -176.971 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.612 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 60.4 t -106.5 106.67 21.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.175 -0.92 . . . . 0.58 109.27 177.13 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.589 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 30.0 t -142.31 147.93 37.17 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.012 0.434 . . . . 0.84 112.081 -174.158 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.626 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 25.0 m120 -67.13 -20.68 65.8 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.5 -0.773 . . . . 1.67 110.891 174.392 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -61.51 -23.96 66.28 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.939 -0.573 . . . . 1.81 111.154 -177.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -100.65 -5.3 26.82 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.476 -0.329 . . . . 3.19 111.477 -175.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.626 ' HG2' ' O ' ' A' ' 62' ' ' ASN . 7.7 pt-20 -77.58 -2.17 34.42 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 120.401 -0.52 . . . . 2.14 111.457 -174.11 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -92.86 4.49 53.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.227 0.536 . . . . 2.03 109.939 176.776 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt 71.82 15.21 5.85 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.18 -0.918 . . . . 3.31 111.062 175.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.427 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 44.0 mmtm -76.39 89.7 3.21 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.195 0.522 . . . . 1.99 110.963 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -73.92 -50.01 22.09 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.609 -0.723 . . . . 2.33 109.899 179.158 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.521 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.61 -34.58 77.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.117 -0.492 . . . . 1.09 111.215 -175.754 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.521 ' N ' HD22 ' A' ' 70' ' ' LEU . 9.4 t70 -73.76 -37.03 65.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.316 0.579 . . . . 2.08 109.878 -178.559 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.425 ' O ' HG23 ' A' ' 76' ' ' VAL . 1.3 tmt_? -63.42 -41.88 98.71 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.752 -0.658 . . . . 2.93 110.018 172.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -63.02 -47.01 84.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.089 -0.505 . . . . 1.21 111.155 -178.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 3.5 ptm180 -66.18 -35.66 81.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.466 -0.334 . . . . 1.67 110.963 -177.75 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.84 -48.34 71.96 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 110.244 -0.28 . . . . 1.48 110.244 176.337 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.531 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 64.6 t -56.92 -42.49 78.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.083 -0.508 . . . . 0.82 110.678 177.292 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.407 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 5.1 m-20 -64.91 -42.95 94.31 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.989 -0.284 . . . . 1.14 111.548 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 57.4 m -65.92 -49.09 69.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.03 0.443 . . . . 0.69 111.349 -176.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.428 ' HB ' HD12 ' A' ' 80' ' ' LEU . 35.1 mt -72.4 -53.37 19.66 Favored 'Isoleucine or valine' 0 C--O 1.241 0.643 0 CA-C-O 121.742 0.782 . . . . 0.77 110.708 -178.329 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 1.053 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.4 mp -79.57 -0.31 33.05 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.175 -0.92 . . . . 0.78 111.965 -172.435 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 17.8 tppt? -53.81 -63.92 0.99 Allowed 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.475 -0.49 . . . . 1.93 109.688 173.066 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -75.76 -33.08 60.21 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.096 -0.502 . . . . 2.91 110.884 173.623 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 1.053 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 1.8 tp10 -52.83 -52.88 55.35 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.787 0.327 . . . . 1.66 111.683 -177.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 61.9 mt -50.49 -30.83 13.71 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.48 -0.782 . . . . 0.58 112.465 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -57.81 -22.38 47.15 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 120.745 0.307 . . . . 0.92 111.077 -177.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -90.47 -7.01 54.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.811 0.338 . . . . 1.02 111.174 -178.502 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.599 HD11 HG21 ' A' ' 29' ' ' ILE . 6.9 mt -123.72 135.45 63.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.504 -0.316 . . . . 0.77 110.498 -174.283 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -69.33 -46.74 66.34 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.561 -0.533 . . . . 1.85 109.561 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -151.94 101.36 2.73 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.239 -0.437 . . . . 0.78 110.947 178.162 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' PHE . . . . . 0.506 ' HB2' HG21 ' A' ' 87' ' ' ILE . 79.1 t80 -103.01 139.28 38.77 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.944 0.402 . . . . 0.63 111.028 178.784 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.7 m -135.19 149.49 49.94 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.32 -0.622 . . . . 1.27 109.32 174.45 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -134.42 134.23 41.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.106 0.479 . . . . 0.64 111.105 -178.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -106.48 116.74 32.46 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.805 -0.634 . . . . 2.23 109.377 177.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 7.2 p -83.62 129.39 34.96 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.016 0.436 . . . . 1.38 111.613 -175.552 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.612 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 0.1 OUTLIER -145.09 158.23 43.88 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.802 -0.636 . . . . 1.98 109.67 176.063 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.403 ' HA ' ' HD3' ' A' ' 97' ' ' PRO . 0.6 OUTLIER -112.03 153.99 44.39 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 116.413 -0.358 . . . . 0.76 111.627 -178.507 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 96' ' ' THR . 27.5 Cg_exo -61.89 -26.86 79.48 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 123.11 2.54 . . . . 0.72 112.724 -176.241 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 98' ' ' LEU . 1.2 tm? -62.45 -51.41 67.62 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.777 -0.453 . . . . 2.08 109.777 -178.868 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.563 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 6.4 mp0 -66.82 -38.8 87.17 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.38 -0.373 . . . . 2.69 111.0 177.168 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -59.42 -39.72 84.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.586 -0.279 . . . . 1.46 111.05 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.531 ' HA ' ' HE3' ' A' ' 104' ' ' LYS . 24.9 t70 -58.46 -34.43 70.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 1.23 110.524 179.246 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.703 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.6 OUTLIER -76.44 -35.47 58.48 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.399 -0.364 . . . . 2.66 110.537 178.455 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.563 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 69.8 mt -65.69 -46.68 78.11 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.94 -0.573 . . . . 1.31 111.396 -178.109 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.57 ' HB2' ' HB2' ' A' ' 7' ' ' HIS . 0.1 OUTLIER -77.8 -21.9 50.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 1.84 111.973 -176.339 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.42 ' N ' ' HD2' ' A' ' 104' ' ' LYS . 41.9 m -82.78 -60.66 2.1 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.995 0.426 . . . . 2.05 110.919 179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.462 ' HE3' ' OXT' ' A' ' 108' ' ' SER . 44.6 pttt -114.09 -56.83 2.35 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.11 -0.495 . . . . 4.02 110.824 -175.032 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 123.89 -30.9 4.71 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 121.075 -0.583 . . . . 3.92 112.027 -179.261 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.462 ' OXT' ' HE3' ' A' ' 106' ' ' LYS . 52.7 p . . . . . 0 C--O 1.251 1.179 0 CA-C-O 118.573 -0.727 . . . . 4.98 110.761 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.3 mtt . . . . . 0 N--CA 1.48 1.065 0 CA-C-O 120.936 0.398 . . . . 36.14 110.194 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 139.54 -159.6 25.85 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 111.327 -0.709 . . . . 33.7 111.327 -177.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.3 t -88.3 89.8 8.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.09 0.472 . . . . 32.35 110.328 178.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.0 m -69.93 134.11 48.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.017 -0.538 . . . . 30.38 109.786 174.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -77.89 123.1 26.35 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.888 0.375 . . . . 28.39 111.215 -176.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 35.4 m80 -71.78 93.98 1.35 Allowed 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.465 -0.569 . . . . 28.54 109.465 177.214 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.0 p-80 -79.38 91.32 5.06 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.694 0.759 . . . . 26.47 110.975 -177.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 35.4 t-80 -75.51 93.06 2.94 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.355 -0.839 . . . . 24.34 109.613 176.541 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 28.4 p80 -59.11 141.2 54.74 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.9 -0.591 . . . . 23.8 111.604 -178.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 44.1 p-80 -127.98 144.87 51.11 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.967 -0.753 . . . . 20.9 108.967 175.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.5 m -70.07 139.82 52.67 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.624 0.25 . . . . 19.89 110.546 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 43.3 m -73.61 85.41 1.59 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.46 0.647 . . . . 17.26 110.001 176.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -172.34 61.62 0.15 Allowed Glycine 0 N--CA 1.445 -0.718 0 CA-C-N 115.041 -0.981 . . . . 16.67 110.671 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -108.37 -34.55 6.76 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.441 0.639 . . . . 19.13 109.647 -175.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.493 ' CD ' ' H ' ' A' ' 15' ' ' GLU . 0.6 OUTLIER -91.21 1.01 57.42 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.154 -0.93 . . . . 14.57 111.066 -178.886 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 30.4 p30 -72.22 -1.51 15.44 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.798 0.332 . . . . 15.4 111.596 -178.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.9 mp -80.88 -17.84 49.28 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.046 0.451 . . . . 16.35 110.31 174.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -89.79 91.82 8.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.166 0.508 . . . . 15.41 111.069 -178.096 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -106.62 9.51 31.33 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.688 -0.687 . . . . 11.39 109.738 176.104 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -74.25 -7.97 54.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.209 -0.905 . . . . 10.77 110.813 179.403 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -68.51 101.94 0.82 Allowed Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.956 -0.64 . . . . 6.73 111.971 179.321 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 60.8 m80 -84.15 170.69 13.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.675 0.274 . . . . 6.08 110.417 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 48.3 tpp -66.95 96.31 0.42 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.892 -0.595 . . . . 4.41 110.381 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 37.8 m -84.41 143.27 29.54 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.852 -0.613 . . . . 1.71 109.788 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 11.2 tp -61.24 -32.03 51.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.611 0.243 . . . . 1.37 110.899 -176.809 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.461 ' HA ' ' OE1' ' A' ' 26' ' ' GLN . 6.4 tp60 -63.14 -37.2 86.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.97 0.414 . . . . 1.75 110.683 179.392 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -71.59 -33.8 69.33 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.226 -0.443 . . . . 2.5 110.054 177.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.43 HG12 ' HE3' ' A' ' 32' ' ' LYS . 62.2 t -61.45 -50.91 78.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.968 -0.56 . . . . 1.04 110.194 177.27 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.483 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.7 mp -58.39 -50.21 79.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.804 -0.635 . . . . 0.79 110.149 176.474 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -53.46 -52.03 60.81 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.727 -0.669 . . . . 2.2 111.579 -178.103 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.8 -42.22 77.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 1.67 112.138 -173.148 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.43 ' HE3' HG12 ' A' ' 28' ' ' VAL . 8.4 mtmp? -66.88 -45.71 77.19 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.595 -0.442 . . . . 2.03 111.564 -175.127 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 4.5 pp -72.31 -28.27 62.97 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.197 -0.601 . . . . 0.57 110.999 177.662 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.443 ' N ' HD12 ' A' ' 33' ' ' LEU . 46.3 t -66.0 -41.82 90.56 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.982 0.42 . . . . 1.29 109.901 175.886 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.7 m -66.93 -27.65 67.65 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.111 0.482 . . . . 0.78 110.686 179.021 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.496 ' HB2' HG12 ' A' ' 79' ' ' ILE . . . -77.15 -53.91 7.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.807 -0.633 . . . . 0.64 111.87 -178.613 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.3 mt -86.79 -26.38 24.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.439 -0.346 . . . . 0.94 111.465 -174.189 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.2 tttp 56.67 75.12 0.6 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.771 -0.65 . . . . 3.36 110.964 -176.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.539 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 23.5 Cg_endo -94.45 144.47 1.66 Allowed 'Trans proline' 0 N--CA 1.448 -1.154 0 C-N-CA 123.29 2.66 . . . . 0.63 112.566 179.141 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 23.9 p -80.58 -23.76 39.66 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.424 0.63 . . . . 0.73 109.489 174.763 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.775 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 76.5 t80 -139.25 125.21 19.81 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.005 -0.998 . . . . 0.76 109.248 175.272 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -142.23 118.73 10.94 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.323 -0.621 . . . . 1.55 109.323 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -131.55 131.89 43.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.518 -0.31 . . . . 2.23 110.908 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -89.55 115.59 27.07 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.975 -0.75 . . . . 1.72 108.975 176.004 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 44.6 t -107.17 132.21 55.19 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.024 0.44 . . . . 1.08 111.502 -175.222 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.28 100.93 0.38 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.515 -0.766 . . . . 1.83 109.255 172.177 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.515 ' HD3' ' HB3' ' A' ' 56' ' ' ASP . 27.4 tptt -89.69 -69.01 0.74 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.013 0.435 . . . . 2.76 109.985 -176.002 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 16.8 t -82.91 112.07 19.37 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.769 -0.65 . . . . 3.2 109.653 -179.462 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.0 p -65.19 129.25 39.03 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.251 0.548 . . . . 4.74 111.169 -176.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 155.13 -138.89 6.32 Favored Glycine 0 N--CA 1.444 -0.767 0 CA-C-N 115.207 -0.906 . . . . 3.16 111.205 -177.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.5 t -86.79 -14.46 42.2 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.022 0.439 . . . . 4.36 110.08 177.622 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 128.77 55.43 0.11 Allowed Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.845 -0.693 . . . . 2.26 111.913 178.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.4 m -68.52 -42.07 79.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.214 0.531 . . . . 3.46 110.912 -179.671 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.0 m -140.01 127.24 21.16 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.79 -0.641 . . . . 1.71 110.142 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -111.55 132.42 54.54 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.719 -0.845 . . . . 1.15 108.719 175.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.515 ' HB3' ' HD3' ' A' ' 47' ' ' LYS . 35.1 t70 -115.56 125.94 53.6 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.947 -0.39 . . . . 1.35 109.947 -175.183 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.15 115.95 31.1 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.199 0.523 . . . . 0.51 111.273 -174.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 62.0 t -78.09 111.85 15.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.391 -0.822 . . . . 0.55 109.061 174.544 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.543 ' CG1' ' HA ' ' A' ' 94' ' ' CYS . 0.9 OUTLIER -105.16 133.89 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-O 121.234 0.54 . . . . 1.18 110.356 -177.559 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.775 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 96.9 t -124.91 101.48 8.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 N-CA-C 108.618 -0.882 . . . . 0.58 108.618 172.125 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.539 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 37.1 t -151.7 154.97 37.37 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.186 -0.461 . . . . 0.84 111.376 -173.211 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -67.46 -18.97 65.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.935 -0.575 . . . . 1.67 110.519 174.6 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -63.42 -1.93 1.34 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 122.804 0.442 . . . . 1.81 112.022 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.594 ' HD2' HG23 ' A' ' 96' ' ' THR . 51.6 t80 -109.69 -7.14 15.12 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.983 -0.448 . . . . 3.19 111.528 179.643 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -75.5 -18.2 59.9 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.688 -0.405 . . . . 2.14 111.606 -171.368 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.5 ' O ' ' HG2' ' A' ' 67' ' ' LYS . 8.7 m-20 -75.59 -15.41 60.36 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.828 -0.169 . . . . 2.03 110.847 175.49 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 66' ' ' ASP . 62.3 pttt 53.6 13.85 0.53 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.759 1.224 . . . . 3.31 113.21 178.482 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -78.82 125.32 29.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.209 0.528 . . . . 1.99 111.276 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 28.0 tp -69.7 -56.67 6.57 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.311 -0.858 . . . . 2.33 111.1 -179.374 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.98 -31.16 72.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.717 -0.674 . . . . 1.09 112.125 -171.858 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.418 ' O ' ' HG2' ' A' ' 74' ' ' ARG . 12.4 t70 -73.76 -45.46 51.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.056 0.455 . . . . 2.08 110.636 -174.626 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 72' ' ' ARG . 12.9 ptt180 -72.49 -31.78 65.65 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.658 -0.497 . . . . 2.93 109.658 178.585 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -60.67 -50.93 71.54 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.086 -0.506 . . . . 1.21 110.349 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.418 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 6.2 ptm180 -63.88 -40.46 96.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.52 -0.309 . . . . 1.67 111.23 -178.647 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 89.0 mt -65.09 -50.24 66.89 Favored 'General case' 0 C--O 1.243 0.715 0 CA-C-O 121.122 0.486 . . . . 1.48 110.754 179.529 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.538 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 47.1 t -55.65 -45.34 78.99 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.586 0 CA-C-N 115.494 -0.776 . . . . 0.82 110.568 178.093 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.405 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 86.4 m-20 -66.96 -27.37 67.4 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 121.007 -0.277 . . . . 1.14 111.431 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 96.4 m -63.19 -54.02 44.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.541 0.21 . . . . 0.69 110.943 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.496 HG12 ' HB2' ' A' ' 36' ' ' ALA . 3.3 mp -82.19 -42.29 18.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 CA-C-O 121.63 0.728 . . . . 0.77 111.006 -178.646 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.878 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.5 mp -76.49 -0.99 25.04 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.041 -0.527 . . . . 0.78 111.757 -176.805 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 51.5 tptt -51.56 -63.37 1.15 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.379 -0.6 . . . . 1.93 109.379 169.503 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -74.63 -34.9 62.88 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.162 -0.472 . . . . 2.91 110.989 176.3 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.878 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 5.5 tp10 -52.55 -55.4 22.48 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.387 0.613 . . . . 1.66 111.975 -178.537 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 65.8 mt -50.51 -30.87 13.92 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 115.174 -0.921 . . . . 0.58 112.756 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -56.64 -23.15 39.37 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.901 0.381 . . . . 0.92 111.098 -176.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -96.54 -1.19 47.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.132 -0.485 . . . . 1.02 111.447 -176.22 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 6.9 mt -127.78 142.32 44.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 110.409 -0.219 . . . . 0.77 110.409 -177.191 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 86.0 t60 -69.98 -56.8 6.04 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.657 -0.417 . . . . 1.85 110.029 175.034 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -143.07 104.09 4.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.119 -0.491 . . . . 0.78 110.533 179.329 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -92.15 133.27 35.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.15 0.5 . . . . 0.63 110.811 177.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 42.5 t -121.04 155.73 33.73 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.178 -0.675 . . . . 1.27 109.178 177.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -143.51 138.97 29.57 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.867 0.365 . . . . 0.64 110.585 -177.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -112.47 109.06 18.43 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.562 -0.533 . . . . 2.23 109.562 174.565 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.543 ' HA ' ' CG1' ' A' ' 59' ' ' ILE . 37.6 m -84.01 111.65 19.48 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.829 -0.623 . . . . 1.38 110.863 -174.256 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -132.05 157.69 43.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.091 0.472 . . . . 1.98 111.063 177.041 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.594 HG23 ' HD2' ' A' ' 64' ' ' PHE . 48.0 p -102.52 159.54 29.04 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.174 -0.467 . . . . 0.76 110.339 176.789 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.536 ' HG2' HD22 ' A' ' 98' ' ' LEU . 18.3 Cg_endo -60.71 -37.26 80.28 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.582 2.188 . . . . 0.72 111.928 177.363 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.536 HD22 ' HG2' ' A' ' 97' ' ' PRO . 2.9 mm? -69.67 -32.64 71.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.109 -0.496 . . . . 2.08 110.362 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 76.6 tt0 -72.17 -50.8 24.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.086 0.47 . . . . 2.69 110.028 177.184 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.526 ' O ' ' HG2' ' A' ' 104' ' ' LYS . 82.6 t80 -62.94 -35.21 79.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.762 -0.654 . . . . 1.46 111.607 -176.524 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.538 ' HA ' ' HD3' ' A' ' 104' ' ' LYS . 37.2 t70 -60.74 -33.0 72.26 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.873 0.368 . . . . 1.23 111.372 -178.6 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.639 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -78.18 -22.54 48.48 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.851 0.357 . . . . 2.66 110.638 177.729 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.502 ' O ' ' HG3' ' A' ' 106' ' ' LYS . 91.2 mt -78.66 -42.81 27.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.204 -0.453 . . . . 1.31 111.092 -178.704 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.538 ' HD3' ' HA ' ' A' ' 101' ' ' ASP . 3.2 ptmt -61.62 -34.99 76.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.453 -0.34 . . . . 1.84 111.503 179.183 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.8 m -63.48 -40.61 97.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.418 -0.356 . . . . 2.05 111.348 -178.684 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.502 ' HG3' ' O ' ' A' ' 103' ' ' LEU . 5.9 ptpt -86.64 -41.16 14.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.889 0.376 . . . . 4.02 111.372 -179.3 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 87.39 -32.35 4.19 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.914 -0.66 . . . . 3.92 112.482 179.271 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 49.5 m . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.61 -0.71 . . . . 4.98 110.203 179.618 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.9 t . . . . . 0 N--CA 1.451 -0.419 0 N-CA-C 108.378 -0.971 . . . . 1.71 108.378 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.8 tp -56.7 -35.77 46.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 120.874 0.369 . . . . 1.37 110.855 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -65.91 -40.09 91.17 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.255 -0.429 . . . . 1.75 110.544 178.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.601 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -61.49 -40.91 96.26 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.787 -0.642 . . . . 2.5 110.447 -178.704 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 54.8 t -63.47 -55.38 23.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.9 -0.591 . . . . 1.04 110.857 -178.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.7 mp -58.22 -47.42 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.112 -0.494 . . . . 0.79 110.878 -179.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.18 -51.26 68.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.085 -0.507 . . . . 2.2 111.121 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -66.9 -34.51 77.94 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.479 -0.328 . . . . 1.67 111.33 -176.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.468 ' HB3' ' NZ ' ' A' ' 32' ' ' LYS . 10.1 mtpm? -63.5 -55.47 23.8 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 111.836 0.31 . . . . 2.03 111.836 -177.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.441 HD12 ' N ' ' A' ' 34' ' ' SER . 3.8 pp -70.46 -28.42 64.99 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.896 -0.322 . . . . 0.57 111.058 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.441 ' N ' HD12 ' A' ' 33' ' ' LEU . 19.6 t -65.37 -39.5 92.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.931 0.396 . . . . 1.29 110.558 178.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.1 m -67.83 -28.07 67.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.387 -0.37 . . . . 0.78 111.363 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.11 -54.96 3.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.309 -0.405 . . . . 0.64 111.961 -174.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.53 HD13 ' HZ ' ' A' ' 64' ' ' PHE . 65.9 mt -87.94 -16.72 33.04 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.707 0.289 . . . . 0.94 111.06 -175.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.5 mttp 49.55 76.39 0.55 Allowed Pre-proline 0 C--O 1.235 0.324 0 CA-C-N 115.348 -0.842 . . . . 3.36 112.635 178.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.479 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 51.5 Cg_endo -89.27 126.68 1.64 Allowed 'Trans proline' 0 N--CA 1.447 -1.259 0 C-N-CA 122.687 2.258 . . . . 0.63 111.769 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.3 p -63.16 -25.54 68.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.118 0.485 . . . . 0.73 110.966 177.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.693 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 89.3 t80 -141.76 141.62 33.23 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.617 -0.72 . . . . 0.76 109.491 175.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 45.7 tp -142.16 116.83 9.76 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.977 -0.379 . . . . 1.55 109.977 178.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.506 ' HB3' ' HB ' ' A' ' 58' ' ' VAL . 5.7 tp10 -105.47 130.05 53.63 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 110.036 -0.357 . . . . 2.23 110.036 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.9 mp -118.44 115.8 25.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.116 0.484 . . . . 1.72 110.82 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 44.1 t -122.13 144.04 32.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.861 -0.609 . . . . 1.08 110.108 179.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -72.67 115.01 11.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.134 0.492 . . . . 1.83 110.602 176.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.516 ' O ' ' HB2' ' A' ' 54' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.319 -0.734 0 N-CA-C 107.794 -1.187 . . . . 2.76 107.794 174.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.516 ' HB2' ' O ' ' A' ' 47' ' ' LYS . 14.1 m . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 108.836 -0.801 . . . . 1.71 108.836 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -111.47 132.84 54.19 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.12 0.486 . . . . 1.15 110.774 -173.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.469 ' HB2' ' CB ' ' A' ' 47' ' ' LYS . 4.2 t70 -117.48 108.72 15.86 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.319 -0.993 . . . . 1.35 108.319 175.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.488 ' HA ' ' O ' ' A' ' 43' ' ' GLU . . . -111.15 124.91 53.13 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.14 0.495 . . . . 0.51 112.08 -171.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.506 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 58.6 t -90.02 116.74 31.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.641 -0.709 . . . . 0.55 109.421 174.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.66 HG12 ' HA ' ' A' ' 94' ' ' CYS . 2.5 pt -97.42 145.29 9.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 121.146 0.498 . . . . 1.18 110.77 -176.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.693 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 89.1 t -131.63 97.66 3.0 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 115.502 -0.772 . . . . 0.58 108.939 174.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.479 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 41.9 t -144.12 138.64 28.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.321 0.582 . . . . 0.84 112.1 -174.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.573 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 8.9 m-80 -67.66 -19.17 65.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.323 -0.853 . . . . 1.67 111.391 174.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -61.69 -22.35 65.25 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.364 0.602 . . . . 1.81 110.581 -178.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.647 ' CD2' ' HD2' ' A' ' 72' ' ' ARG . 13.5 m-85 -102.44 -5.91 23.55 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.943 -0.571 . . . . 3.19 112.156 -174.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.573 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -80.92 -10.09 59.76 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.946 0.403 . . . . 2.14 110.69 -176.85 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -75.79 -9.3 58.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.82 -0.627 . . . . 2.03 109.817 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.449 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 2.7 mmmp? 68.55 18.6 8.88 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.169 -0.923 . . . . 3.31 111.942 175.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.794 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 31.1 mmmt -69.5 89.79 0.52 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.347 -0.388 . . . . 1.99 109.995 174.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -63.77 -59.67 4.26 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.742 0.306 . . . . 2.33 110.476 -175.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.426 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.19 -31.18 71.4 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.188 -0.46 . . . . 1.09 111.31 -177.327 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.794 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 27.0 t70 -73.91 -43.95 56.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.498 -0.319 . . . . 2.08 110.788 -175.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.647 ' HD2' ' CD2' ' A' ' 64' ' ' PHE . 26.8 ptt180 -69.14 -31.93 70.94 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.297 -0.561 . . . . 2.93 109.76 177.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -65.03 -49.72 69.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.152 -0.477 . . . . 1.21 110.515 177.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.631 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 3.0 ptm180 -63.59 -40.93 98.21 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.52 -0.309 . . . . 1.67 110.767 -179.243 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.26 -50.34 68.33 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.631 0.253 . . . . 1.48 110.935 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 72' ' ' ARG . 49.2 t -56.58 -47.03 82.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.304 -0.407 . . . . 0.82 110.94 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -66.56 -29.93 70.12 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 121.097 -0.241 . . . . 1.14 111.619 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 85.4 m -67.61 -43.91 79.31 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.865 0.364 . . . . 0.69 111.307 -179.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.3 mp -81.29 -42.9 20.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 CA-C-O 121.331 0.586 . . . . 0.77 110.623 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.755 ' HA ' ' CB ' ' A' ' 83' ' ' GLU . 10.9 mp -73.27 -3.64 28.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.148 -0.478 . . . . 0.78 111.129 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 45.6 tptt -51.8 -63.29 1.18 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.534 -0.543 . . . . 1.93 109.534 169.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -75.16 -33.28 61.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.958 0.409 . . . . 2.91 110.346 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.755 ' CB ' ' HA ' ' A' ' 80' ' ' LEU . 1.9 tp10 -54.02 -56.23 19.93 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.751 0.786 . . . . 1.66 111.727 -176.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 57.5 mt -50.25 -30.95 12.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.243 -1.344 . . . . 0.58 112.882 177.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -54.76 -24.43 22.43 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.031 0.378 . . . . 0.92 111.608 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -102.6 -0.02 32.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.553 -0.294 . . . . 1.02 111.75 -176.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 8.3 mt -126.13 139.88 50.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.683 0.278 . . . . 0.77 110.383 -176.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 50.0 t60 -70.37 -42.19 72.11 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.804 -0.443 . . . . 1.85 109.804 175.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.418 ' O ' ' HB3' ' A' ' 54' ' ' SER . . . -157.54 111.6 2.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.159 -0.473 . . . . 0.78 110.629 177.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -103.11 121.87 43.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.387 -0.369 . . . . 0.63 110.504 176.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.3 m -111.33 147.32 35.37 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.754 -0.657 . . . . 1.27 109.494 177.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -135.82 142.17 44.81 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.013 0.435 . . . . 0.64 111.433 -178.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -109.49 112.98 25.39 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.291 -0.633 . . . . 2.23 109.291 173.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.66 ' HA ' HG12 ' A' ' 59' ' ' ILE . 5.7 p -83.54 116.22 22.47 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.923 -0.581 . . . . 1.38 111.224 -175.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -143.62 166.95 23.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.29 0.566 . . . . 1.98 111.372 176.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.527 HG21 ' HB3' ' A' ' 65' ' ' GLU . 22.0 p -113.87 163.32 19.07 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 115.544 -0.753 . . . . 0.76 110.901 -179.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . 0.518 ' HG2' ' ND2' ' A' ' 62' ' ' ASN . 31.4 Cg_exo -60.95 -24.0 78.52 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.759 2.306 . . . . 0.72 111.899 177.396 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -66.44 -49.35 67.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.844 -0.616 . . . . 2.08 110.032 178.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.546 ' HA ' ' HD3' ' A' ' 102' ' ' LYS . 34.4 mt-10 -76.96 -30.44 56.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.071 -0.513 . . . . 2.69 110.682 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 52.0 t80 -66.88 -41.45 87.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.435 -0.348 . . . . 1.46 110.976 177.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -57.13 -38.14 73.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.027 0.442 . . . . 1.23 110.77 178.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.546 ' HD3' ' HA ' ' A' ' 99' ' ' GLU . 15.2 mtpp -58.07 -48.05 81.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.852 -0.613 . . . . 2.66 110.558 178.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 53.2 mt . . . . . 0 C--N 1.323 -0.561 0 CA-C-N 115.85 -0.614 . . . . 1.31 111.682 -175.85 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.575 ' O ' HG23 ' A' ' 28' ' ' VAL . 21.3 t . . . . . 0 N--CA 1.453 -0.319 0 N-CA-C 109.591 -0.522 . . . . 1.71 109.591 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.0 tp -57.06 -38.65 61.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 O-C-N 123.242 0.339 . . . . 1.37 111.088 -176.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -61.68 -43.86 98.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.928 0.394 . . . . 1.75 110.279 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -71.27 -26.3 62.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.122 -0.49 . . . . 2.5 111.01 -177.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.575 HG23 ' O ' ' A' ' 24' ' ' CYS . 91.2 t -61.76 -53.86 42.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.367 -0.379 . . . . 1.04 110.19 176.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.482 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.8 mp -61.17 -43.76 97.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.784 -0.644 . . . . 0.79 110.228 178.424 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -52.67 -51.81 58.56 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 116.028 -0.533 . . . . 2.2 111.769 178.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -69.69 -30.93 68.7 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.283 0.563 . . . . 1.67 110.684 -177.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 31.1 tttm -68.57 -54.48 16.35 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.378 -0.828 . . . . 2.03 111.065 -176.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 3.9 pp -71.92 -27.04 62.55 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 120.757 -0.377 . . . . 0.57 111.048 176.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.466 ' N ' HD12 ' A' ' 33' ' ' LEU . 44.3 t -61.93 -44.04 97.6 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-O 120.805 0.336 . . . . 1.29 110.226 176.301 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.2 m -64.22 -27.37 69.01 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.327 -0.397 . . . . 0.78 110.965 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.86 -54.43 5.6 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.093 0.405 . . . . 0.64 112.093 -177.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.0 mt -97.07 -35.59 10.77 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.867 0.365 . . . . 0.94 111.725 -174.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.49 ' HD3' ' HA ' ' A' ' 38' ' ' LYS . 31.8 mmtt 58.15 87.29 0.14 Allowed Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.364 -0.835 . . . . 3.36 112.862 -177.631 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.817 ' HB3' HG12 ' A' ' 59' ' ' ILE . 73.7 Cg_endo -82.91 137.62 8.77 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 122.62 2.213 . . . . 0.63 111.34 171.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 33.4 p -77.54 -23.89 50.01 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.42 0.629 . . . . 0.73 109.695 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.623 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 83.9 t80 -136.3 124.05 22.5 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.123 -0.944 . . . . 0.76 109.176 172.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.419 HD12 ' O ' ' A' ' 58' ' ' VAL . 56.7 tp -134.9 113.86 11.97 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.432 -0.349 . . . . 1.55 110.337 -177.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -120.37 124.85 46.54 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.385 -0.371 . . . . 2.23 110.974 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 67.1 mt -86.4 122.16 29.97 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.172 0.511 . . . . 1.72 110.787 175.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 67.6 t -106.96 111.09 34.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.479 -0.782 . . . . 1.08 109.05 175.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -69.28 102.11 1.65 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.994 -0.548 . . . . 1.83 109.977 -177.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 36.2 mmtm . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 116.046 -0.525 . . . . 2.76 111.05 -177.568 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.3 m . . . . . 0 N--CA 1.452 -0.372 0 CA-C-O 120.906 0.384 . . . . 1.71 110.993 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -111.43 138.69 47.61 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.091 -0.504 . . . . 1.15 110.384 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -116.54 123.02 46.38 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.24 -0.652 . . . . 1.35 109.24 176.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.98 115.74 30.74 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.863 0.363 . . . . 0.51 110.899 -176.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.789 HG22 ' HE2' ' A' ' 93' ' ' LYS . 38.3 t -81.07 110.95 17.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 108.621 -0.881 . . . . 0.55 108.621 173.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.817 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -111.53 107.7 23.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 CA-C-O 121.679 0.752 . . . . 1.18 110.485 -174.011 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.623 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 58.0 t -104.58 106.64 20.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 CA-C-N 114.94 -1.027 . . . . 0.58 108.464 174.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.589 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 32.7 t -142.84 147.43 35.41 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.755 0.65 . . . . 0.84 112.755 -170.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.473 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 0.6 OUTLIER -64.09 -22.19 66.83 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 114.988 -1.006 . . . . 1.67 110.829 173.258 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -63.35 -35.62 81.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.188 0.518 . . . . 1.81 110.417 -177.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.415 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 27.2 t80 -100.49 12.04 38.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.318 0.58 . . . . 3.19 110.118 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.473 ' HB3' ' O ' ' A' ' 62' ' ' ASN . 2.2 tp10 -81.31 -28.55 34.55 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 108.087 -1.079 . . . . 2.14 108.087 176.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.599 ' OD2' ' HG3' ' A' ' 68' ' ' LYS . 21.0 t70 -57.32 -41.13 79.33 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 108.293 -1.003 . . . . 2.03 108.293 166.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.0 ttpm? 75.59 25.02 1.25 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 114.476 -1.238 . . . . 3.31 113.161 161.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.599 ' HG3' ' OD2' ' A' ' 66' ' ' ASP . 36.7 mtmm -74.76 122.53 23.44 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 121.97 -0.456 . . . . 1.99 109.959 169.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.5 pp -74.0 -32.18 63.28 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.772 -0.371 . . . . 2.33 110.953 -175.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.504 HD13 ' HB3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -67.72 -30.81 70.4 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.038 0.447 . . . . 1.09 110.417 177.32 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.469 ' HB2' ' HE2' ' A' ' 68' ' ' LYS . 36.0 t70 -72.62 -36.91 68.16 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.155 0.502 . . . . 2.08 109.658 179.49 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.415 ' HB2' ' CE1' ' A' ' 64' ' ' PHE . 48.3 ttt-85 -57.77 -47.25 83.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.496 -0.775 . . . . 2.93 109.563 172.309 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -57.22 -54.46 46.5 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.143 -0.935 . . . . 1.21 111.28 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.428 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 13.2 ptm180 -70.7 -46.42 63.15 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.285 0.476 . . . . 1.67 112.285 -172.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 75' ' ' LEU . 27.3 mt -63.08 -45.97 89.63 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 111.759 0.281 . . . . 1.48 111.759 -176.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.536 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 58.7 t -58.05 -48.25 84.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.57 -0.286 . . . . 0.82 110.487 179.002 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -66.58 -31.7 72.57 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.687 -0.405 . . . . 1.14 111.564 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 99.2 m -61.71 -61.41 2.53 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.655 0.242 . . . . 0.69 111.655 -178.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.5 mp -75.95 -43.8 38.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-O 121.071 0.463 . . . . 0.77 110.833 -176.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.802 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.4 mp -77.65 -7.55 56.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.903 -0.59 . . . . 0.78 112.338 -171.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -50.13 -62.55 1.51 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.277 0.56 . . . . 1.93 109.9 171.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -75.15 -33.52 61.53 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.448 -0.796 . . . . 2.91 110.708 177.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.802 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.3 tp10 -56.29 -53.53 56.21 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.477 0.656 . . . . 1.66 112.026 -176.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.672 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 66.3 mt -50.72 -30.44 13.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.711 -1.131 . . . . 0.58 112.505 179.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -53.5 -27.36 25.07 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.046 0.451 . . . . 0.92 111.038 -178.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -87.0 -6.78 58.64 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.804 -0.634 . . . . 1.02 111.701 -175.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.476 HD12 ' HB2' ' A' ' 90' ' ' PHE . 3.2 mt -125.52 160.36 31.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 109.969 -0.382 . . . . 0.77 109.969 -176.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -79.36 -54.82 5.56 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.421 -0.585 . . . . 1.85 109.421 174.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -145.26 115.59 7.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.828 -0.624 . . . . 0.78 110.176 177.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . 0.476 ' HB2' HD12 ' A' ' 87' ' ' ILE . 86.2 t80 -108.4 129.19 55.26 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.161 0.505 . . . . 0.63 110.605 177.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 38.2 t -115.02 146.76 40.93 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.267 -0.879 . . . . 1.27 109.25 177.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -129.3 130.69 46.48 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.929 0.395 . . . . 0.64 110.417 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.789 ' HE2' HG22 ' A' ' 58' ' ' VAL . 2.3 ttmm -113.7 109.01 17.9 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.864 -0.791 . . . . 2.23 108.864 176.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.514 ' HA ' HG23 ' A' ' 59' ' ' ILE . 13.2 p -92.16 140.9 29.17 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.934 0.397 . . . . 1.38 111.358 -172.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.617 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 8.7 t60 -153.65 154.43 34.16 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.939 -0.573 . . . . 1.98 109.712 177.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.407 ' CG2' ' HA ' ' A' ' 65' ' ' GLU . 1.3 p -96.6 148.79 34.97 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 121.042 0.449 . . . . 0.76 112.093 -177.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -67.87 -35.34 21.31 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 123.255 2.637 . . . . 0.72 113.075 -176.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' A' ' 98' ' ' LEU . 4.4 mm? -59.4 -48.22 82.46 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.112 0.482 . . . . 2.08 110.225 179.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -66.24 -33.78 76.52 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.623 -0.717 . . . . 2.69 111.012 177.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 49.7 t80 -69.83 -33.99 73.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.469 -0.332 . . . . 1.46 111.4 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -58.08 -35.15 70.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.94 0.4 . . . . 1.23 111.087 -178.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.704 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -74.91 -29.35 60.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.907 0.384 . . . . 2.66 110.378 178.528 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 89.7 mt . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 115.941 -0.572 . . . . 1.31 110.67 179.19 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 32.3 m . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 120.534 0.206 . . . . 1.71 110.74 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.3 tp -57.2 -34.04 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-O 121.178 0.513 . . . . 1.37 110.925 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.422 HE21 ' HB2' ' A' ' 44' ' ' LEU . 60.9 tt0 -65.52 -38.89 91.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.104 -0.498 . . . . 1.75 110.922 178.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.718 ' HA ' ' HE3' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -68.4 -46.57 69.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.093 -0.503 . . . . 2.5 111.193 -175.615 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.533 ' O ' ' HG2' ' A' ' 32' ' ' LYS . 5.3 p -64.87 -46.04 93.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 C-N-CA 120.833 -0.347 . . . . 1.04 111.163 -177.445 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.47 HD12 HG13 ' A' ' 28' ' ' VAL . 1.7 mp -60.71 -47.62 92.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-O 121.033 0.444 . . . . 0.79 110.721 178.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.64 -42.02 91.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.326 -0.397 . . . . 2.2 110.77 -178.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -68.04 -35.4 78.2 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.167 -0.47 . . . . 1.67 111.423 -175.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 28' ' ' VAL . 74.1 mmtt -65.06 -55.61 17.84 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.935 0.398 . . . . 2.03 111.067 -178.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.497 HD12 ' N ' ' A' ' 34' ' ' SER . 3.3 pp -71.81 -28.9 63.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.126 -0.488 . . . . 0.57 112.135 -174.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.497 ' N ' HD12 ' A' ' 33' ' ' LEU . 69.7 m -69.23 -43.05 74.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.769 0.319 . . . . 1.29 110.97 179.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.7 m -71.3 -27.45 63.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.1 0.476 . . . . 0.78 111.076 -178.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.65 -54.94 4.0 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.032 0.382 . . . . 0.64 112.032 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.1 mt -81.85 -32.04 31.33 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.848 0.314 . . . . 0.94 111.848 -173.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm 65.16 74.77 0.38 Allowed Pre-proline 0 N--CA 1.468 0.456 0 O-C-N 123.595 0.559 . . . . 3.36 110.99 -175.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.6 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 63.0 Cg_endo -88.66 134.76 2.83 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 122.289 1.993 . . . . 0.63 112.374 176.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 30.4 p -68.86 -30.56 69.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.276 0.56 . . . . 0.73 109.64 175.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.677 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 86.3 t80 -141.91 134.27 27.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.325 -0.852 . . . . 0.76 109.262 174.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.414 HD22 ' HA ' ' A' ' 42' ' ' LEU . 1.4 tm? -142.24 126.16 17.19 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.547 -0.538 . . . . 1.55 109.547 -178.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -137.48 127.79 26.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.889 0.375 . . . . 2.23 110.934 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.422 ' HB2' HE21 ' A' ' 26' ' ' GLN . 2.5 mm? -90.61 115.76 27.98 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.368 -0.604 . . . . 1.72 109.368 177.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 52.5 t -109.08 118.25 56.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.901 0.382 . . . . 1.08 110.769 -178.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -91.19 123.64 34.79 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.108 -0.701 . . . . 1.83 109.108 173.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 60.6 tttp . . . . . 0 C--N 1.322 -0.591 0 CA-C-O 120.791 0.329 . . . . 2.76 110.857 -179.752 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 62.3 m . . . . . 0 N--CA 1.45 -0.443 0 N-CA-C 109.109 -0.701 . . . . 1.71 109.109 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -111.39 137.6 48.96 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.597 -0.274 . . . . 1.15 110.82 -176.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -102.18 110.23 22.13 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.754 -1.202 . . . . 1.35 107.754 168.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.77 117.53 34.25 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 120.899 0.38 . . . . 0.51 111.268 -171.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.7 t -73.39 111.27 7.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 109.026 -0.731 . . . . 0.55 109.026 176.285 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -106.87 107.81 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 CA-C-O 121.774 0.797 . . . . 1.18 109.571 -178.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.677 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 58.7 t -108.21 103.97 16.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.108 -0.951 . . . . 0.58 108.971 177.087 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.6 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 29.0 t -145.26 153.27 41.13 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.986 0.422 . . . . 0.84 111.291 -175.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.743 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 22.9 m120 -67.44 -19.21 65.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.486 -0.779 . . . . 1.67 110.477 175.083 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -63.65 -18.97 64.5 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.236 0.541 . . . . 1.81 110.384 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.612 ' HD2' HG23 ' A' ' 96' ' ' THR . 62.9 t80 -93.46 -19.8 20.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 3.19 111.561 -178.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.743 ' HG2' ' O ' ' A' ' 62' ' ' ASN . 11.9 pt-20 -71.23 -20.06 62.29 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.627 -0.429 . . . . 2.14 110.474 -176.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.633 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . 17.2 m-20 -69.15 -20.48 64.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.029 -0.532 . . . . 2.03 110.581 175.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.402 ' HD3' ' HA ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER 64.11 19.74 11.89 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.453 -0.794 . . . . 3.31 110.777 177.222 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.633 ' HG2' ' HB3' ' A' ' 66' ' ' ASP . 31.3 mmmt -79.54 102.63 8.95 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.907 -0.588 . . . . 1.99 110.323 -178.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.411 HD12 ' N ' ' A' ' 70' ' ' LEU . 3.7 pp -67.55 -44.22 78.8 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.324 -0.398 . . . . 2.33 110.767 -177.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.431 ' CD1' ' H ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.73 -31.24 71.04 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.49 -0.323 . . . . 1.09 111.254 -178.972 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.703 ' HA ' ' HD2' ' A' ' 74' ' ' ARG . 4.8 m-20 -73.55 -44.77 56.68 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 121.094 -0.242 . . . . 2.08 111.345 -178.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 18.3 ptt180 -67.89 -31.93 72.07 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.909 -0.716 . . . . 2.93 109.82 176.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -64.03 -50.97 66.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.071 -0.513 . . . . 1.21 110.521 176.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.703 ' HD2' ' HA ' ' A' ' 71' ' ' ASP . 5.0 ptm180 -63.57 -39.55 94.68 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.399 -0.364 . . . . 1.67 110.836 -177.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -66.48 -51.84 52.48 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.723 0.297 . . . . 1.48 111.046 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.705 HG13 HD22 ' A' ' 80' ' ' LEU . 45.6 t -57.74 -45.69 86.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.065 -0.516 . . . . 0.82 110.978 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.555 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 12.7 m120 -62.73 -42.01 99.45 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.475 -0.49 . . . . 1.14 111.262 -178.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.467 ' HB ' HD12 ' A' ' 79' ' ' ILE . 89.3 m -58.76 -54.67 44.44 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.113 0.412 . . . . 0.69 112.113 -175.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.467 HD12 ' HB ' ' A' ' 78' ' ' THR . 4.3 mp -88.01 -48.51 15.04 Favored 'Isoleucine or valine' 0 C--O 1.242 0.663 0 CA-C-O 121.643 0.735 . . . . 0.77 111.016 -175.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.79 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 7.7 mp -73.31 -4.37 32.82 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.654 -0.703 . . . . 0.78 111.668 -173.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.555 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 17.6 tppt? -55.72 -60.0 4.07 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.358 -0.608 . . . . 1.93 109.358 168.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.453 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 6.9 mm-40 -67.72 -32.94 73.91 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.65 -0.705 . . . . 2.91 110.261 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.642 ' CB ' ' HA ' ' A' ' 80' ' ' LEU . 2.6 tp10 -54.59 -55.35 30.35 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.815 -0.63 . . . . 1.66 111.054 176.187 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.79 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 56.3 mt -51.03 -30.58 15.88 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.273 -0.876 . . . . 0.58 112.46 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.453 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 23.1 mm-40 -54.41 -25.52 25.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.64 0.257 . . . . 0.92 111.436 -176.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -106.63 8.28 31.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.716 0.293 . . . . 1.02 111.326 -177.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 11.2 mt -129.35 155.81 41.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 109.635 -0.506 . . . . 0.77 109.635 -178.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -86.9 -61.11 1.8 Allowed 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.414 -0.514 . . . . 1.85 109.778 175.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -137.85 95.15 2.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.056 0.455 . . . . 0.78 110.99 178.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -84.68 119.63 25.47 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.018 -0.537 . . . . 0.63 110.204 176.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 38.0 m -112.42 157.13 21.43 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.556 -0.535 . . . . 1.27 109.556 177.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -134.97 137.78 43.38 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.96 0.409 . . . . 0.64 110.655 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -103.12 109.0 20.41 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.338 -0.986 . . . . 2.23 108.338 176.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.7 m -88.08 127.84 35.41 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 111.837 0.31 . . . . 1.38 111.837 -169.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.617 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 73.0 m-70 -148.42 160.95 42.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.108 0.48 . . . . 1.98 110.668 174.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.612 HG23 ' HD2' ' A' ' 64' ' ' PHE . 22.6 p -108.44 159.42 30.87 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.771 -0.65 . . . . 0.76 110.697 176.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -59.26 -26.35 81.5 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.594 2.196 . . . . 0.72 111.834 176.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -62.9 -49.78 73.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.012 -0.54 . . . . 2.08 109.961 176.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.481 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 30.5 mt-10 -60.4 -47.71 84.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.873 -0.603 . . . . 2.69 110.313 176.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -60.43 -39.16 86.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.617 -0.72 . . . . 1.46 111.087 -177.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -60.78 -37.68 82.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.954 0.407 . . . . 1.23 110.772 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.538 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.3 OUTLIER -71.92 -32.35 67.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.138 -0.483 . . . . 2.66 110.362 178.6 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 85.7 mt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.071 -0.513 . . . . 1.31 110.83 177.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 84.5 m . . . . . 0 C--O 1.232 0.171 0 CA-C-O 120.734 0.302 . . . . 1.71 110.884 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 10.1 tp -59.48 -30.06 43.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.931 -0.577 . . . . 1.37 110.948 -178.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -60.31 -43.41 96.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.198 -0.455 . . . . 1.75 110.437 177.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.543 ' HE3' ' HB2' ' A' ' 31' ' ' ASP . 38.8 tptt -67.5 -36.92 82.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.956 -0.565 . . . . 2.5 110.843 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 61.3 t -57.91 -52.24 60.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.061 0.457 . . . . 1.04 110.589 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.475 HG13 ' HG3' ' A' ' 83' ' ' GLU . 1.8 mp -64.35 -47.34 90.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.808 -0.633 . . . . 0.79 110.542 178.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -54.81 -52.05 63.9 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 116.218 -0.446 . . . . 2.2 110.892 -179.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.543 ' HB2' ' HE3' ' A' ' 27' ' ' LYS . 10.6 t70 -66.07 -31.09 71.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.245 -0.434 . . . . 1.67 110.971 -174.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 52.3 tptt -70.15 -55.63 8.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.517 -0.31 . . . . 2.03 111.258 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.511 HD12 ' N ' ' A' ' 34' ' ' SER . 3.9 pp -71.47 -26.32 62.66 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.894 -0.322 . . . . 0.57 111.168 -178.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.511 ' N ' HD12 ' A' ' 33' ' ' LEU . 9.5 t -66.77 -42.24 86.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.94 0.4 . . . . 1.29 110.132 178.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 26.3 m -71.59 -27.07 62.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.12 0.486 . . . . 0.78 111.027 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.79 -52.2 7.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.121 -0.49 . . . . 0.64 111.615 -178.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.2 mt -83.65 -42.09 17.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.504 -0.316 . . . . 0.94 111.23 -176.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 56.92 83.94 0.22 Allowed Pre-proline 0 N--CA 1.464 0.227 0 CA-C-O 121.694 0.759 . . . . 3.36 111.436 -175.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.618 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 74.2 Cg_endo -92.24 151.47 3.11 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 123.271 2.647 . . . . 0.63 112.991 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.7 p -76.95 -27.24 54.75 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.419 0.628 . . . . 0.73 109.958 175.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.776 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 88.6 t80 -141.73 132.52 25.74 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.336 -0.847 . . . . 0.76 109.082 173.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.55 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 60.0 tp -142.38 121.42 12.89 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 110.317 -0.253 . . . . 1.55 110.317 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -124.4 115.83 21.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.065 0.46 . . . . 2.23 110.78 178.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -85.94 115.5 23.6 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.135 -0.691 . . . . 1.72 109.135 174.047 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.593 HG12 ' HG3' ' A' ' 47' ' ' LYS . 19.8 t -106.13 113.56 43.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 120.913 0.387 . . . . 1.08 110.711 -177.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -72.66 106.08 4.53 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.937 -0.574 . . . . 1.83 110.042 175.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.593 ' HG3' HG12 ' A' ' 45' ' ' VAL . 56.4 mtmt . . . . . 0 C--N 1.321 -0.648 0 CA-C-N 115.816 -0.629 . . . . 2.76 109.706 177.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.426 ' HA ' ' O ' ' A' ' 89' ' ' ALA . 25.0 p . . . . . 0 N--CA 1.451 -0.39 0 CA-C-O 120.894 0.378 . . . . 1.71 110.384 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -124.96 137.69 54.25 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.176 -0.466 . . . . 1.15 110.442 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -114.68 122.04 45.23 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.831 -0.622 . . . . 1.35 109.519 178.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -107.11 115.99 31.14 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.911 0.386 . . . . 0.51 111.861 -174.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.2 t -83.25 111.76 19.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.19 -0.67 . . . . 0.55 109.19 173.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -111.97 115.09 48.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.646 0.736 . . . . 1.18 110.594 -174.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.776 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 74.7 t -114.49 106.83 21.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.013 -0.994 . . . . 0.58 109.411 176.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.618 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 42.5 t -146.7 153.01 39.76 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.87 0.692 . . . . 0.84 112.87 -173.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.46 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 12.4 m120 -67.31 -22.0 65.64 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.109 -0.95 . . . . 1.67 110.518 172.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -65.57 -24.04 66.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.293 0.568 . . . . 1.81 110.13 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.445 ' CE1' ' HD3' ' A' ' 72' ' ' ARG . 71.0 t80 -103.06 -2.93 26.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.683 -0.69 . . . . 3.19 110.449 178.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.477 ' HA ' HG21 ' A' ' 96' ' ' THR . 0.9 OUTLIER -72.49 -33.18 66.77 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.584 -0.525 . . . . 2.14 109.584 -175.157 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.653 ' OD2' ' HD3' ' A' ' 68' ' ' LYS . 3.1 t70 -63.6 -14.41 51.29 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.716 -0.476 . . . . 2.03 109.716 176.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 30.6 mtmm 63.25 50.08 3.09 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.159 -0.928 . . . . 3.31 111.458 174.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.653 ' HD3' ' OD2' ' A' ' 66' ' ' ASP . 30.5 mmmt -89.37 96.09 10.56 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.091 -0.959 . . . . 1.99 110.527 179.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 46.9 tp -55.69 -64.31 0.89 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.018 -0.537 . . . . 2.33 111.741 -178.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.419 ' CD1' ' H ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -65.92 -31.01 71.69 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.211 -0.449 . . . . 1.09 111.46 -175.143 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.579 ' HB2' ' HB3' ' A' ' 68' ' ' LYS . 23.3 m-20 -73.59 -36.42 65.54 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.844 0.313 . . . . 2.08 111.844 -176.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.445 ' HD3' ' CE1' ' A' ' 64' ' ' PHE . 25.0 ptt85 -69.9 -32.93 71.52 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 119.891 -0.724 . . . . 2.93 109.393 175.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -64.73 -49.36 71.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.693 -0.685 . . . . 1.21 110.231 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.525 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 4.2 ptm180 -69.57 -40.51 76.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.864 -0.607 . . . . 1.67 111.508 -178.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 35.9 tp -64.96 -47.2 78.46 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.732 0.301 . . . . 1.48 110.743 -177.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.636 HG13 HD22 ' A' ' 80' ' ' LEU . 37.2 t -57.31 -48.32 82.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.98 -0.554 . . . . 0.82 110.701 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -61.19 -33.58 73.69 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.652 -0.249 . . . . 1.14 111.533 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 95.9 m -63.62 -56.16 17.97 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 111.804 0.298 . . . . 0.69 111.804 -178.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.2 mp -76.78 -46.84 29.62 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 CA-C-O 121.317 0.58 . . . . 0.77 110.744 -178.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.948 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 9.1 mp -73.16 -3.6 27.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.879 -0.6 . . . . 0.78 111.589 -175.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 48.0 tptt -50.64 -63.69 1.04 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.635 -0.506 . . . . 1.93 109.635 170.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -75.07 -36.49 61.77 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.417 -0.356 . . . . 2.91 110.622 177.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.948 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 34.4 tt0 -57.09 -45.32 83.45 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.349 -0.387 . . . . 1.66 111.895 -176.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 42.4 mt -56.81 -30.78 64.05 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.471 0.545 . . . . 0.58 112.471 -177.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -54.93 -24.57 24.3 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 120.857 0.36 . . . . 0.92 111.5 -174.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -91.44 -4.78 55.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.247 -0.433 . . . . 1.02 111.129 -175.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.444 HD11 HG12 ' A' ' 29' ' ' ILE . 6.0 mt -124.25 137.65 56.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.444 -0.344 . . . . 0.77 110.187 -176.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -75.96 -47.72 23.95 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.626 -0.509 . . . . 1.85 109.626 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.426 ' O ' ' HA ' ' A' ' 54' ' ' SER . . . -141.23 96.65 3.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.987 0.423 . . . . 0.78 111.217 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -92.79 144.61 25.12 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.167 -0.469 . . . . 0.63 110.155 175.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 50.0 m -135.51 162.09 33.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.188 -0.46 . . . . 1.27 109.773 175.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -144.95 148.87 34.31 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.976 0.417 . . . . 0.64 110.845 -178.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -125.34 109.09 12.36 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.798 -0.816 . . . . 2.23 108.798 174.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 7.9 p -93.78 124.75 37.99 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.721 0.296 . . . . 1.38 111.688 -173.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.493 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 22.1 m-70 -147.95 174.19 12.13 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 121.183 0.516 . . . . 1.98 111.122 176.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.685 ' HB ' ' HD2' ' A' ' 97' ' ' PRO . 72.2 p -116.46 164.3 18.8 Favored Pre-proline 0 C--O 1.243 0.746 0 CA-C-N 116.014 -0.539 . . . . 0.76 111.451 -177.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . 0.685 ' HD2' ' HB ' ' A' ' 96' ' ' THR . 14.5 Cg_endo -57.69 -20.75 44.1 Favored 'Trans proline' 0 C--O 1.219 -0.425 0 C-N-CA 122.826 2.35 . . . . 0.72 112.138 178.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.549 ' O ' ' HD2' ' A' ' 102' ' ' LYS . 4.0 mm? -62.46 -51.15 68.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.706 0.289 . . . . 2.08 110.236 177.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.574 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 3.4 mp0 -61.54 -46.32 90.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.398 . . . . 2.69 110.567 177.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -67.03 -42.49 84.78 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.517 -0.473 . . . . 1.46 111.75 -177.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -64.87 -33.04 75.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.855 0.36 . . . . 1.23 110.45 -178.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.549 ' HD2' ' O ' ' A' ' 98' ' ' LEU . 1.1 mpmm? -73.9 -20.3 60.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.518 -0.31 . . . . 2.66 110.978 177.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 82.1 mt . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 121.082 0.468 . . . . 1.31 109.915 174.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.492 ' O ' HG23 ' A' ' 28' ' ' VAL . 53.5 t . . . . . 0 N--CA 1.458 -0.048 0 N-CA-C 109.731 -0.47 . . . . 1.71 109.731 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.544 HD11 ' HB3' ' A' ' 86' ' ' ASN . 6.3 tp -49.49 -47.74 20.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 N-CA-C 112.19 0.441 . . . . 1.37 112.19 -175.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -63.72 -44.08 94.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.802 0.334 . . . . 1.75 110.322 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -64.73 -36.02 82.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.923 -0.58 . . . . 2.5 111.235 -178.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 24' ' ' CYS . 95.6 t -58.87 -55.54 22.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 N-CA-C 110.37 -0.233 . . . . 1.04 110.37 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.438 HG21 HD11 ' A' ' 87' ' ' ILE . 1.9 mp -66.19 -42.19 90.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.894 0.378 . . . . 0.79 110.586 -179.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -58.67 -52.2 66.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.909 -0.587 . . . . 2.2 111.534 -177.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -73.71 -31.29 63.32 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.413 -0.358 . . . . 1.67 110.81 -172.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 mmmp? -60.78 -55.57 31.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.209 -0.45 . . . . 2.03 111.578 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.411 HD12 ' N ' ' A' ' 34' ' ' SER . 4.0 pp -70.33 -26.58 63.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.73 0.3 . . . . 0.57 110.8 -179.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.477 ' O ' ' HA ' ' A' ' 38' ' ' LYS . 70.0 m -69.22 -34.17 74.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.765 0.316 . . . . 1.29 110.518 175.636 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.6 m -71.68 -34.32 69.58 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.909 0.385 . . . . 0.78 110.788 175.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.27 -54.85 7.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.012 -0.54 . . . . 0.64 111.92 -177.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.7 mt -89.25 -29.33 19.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.645 0.259 . . . . 0.94 111.066 -176.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.49 ' HE3' ' HB2' ' A' ' 38' ' ' LYS . 17.5 ttmt 60.99 78.78 0.3 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.737 -0.665 . . . . 3.36 111.33 176.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.487 ' HG2' ' HB2' ' A' ' 42' ' ' LEU . 59.1 Cg_endo -94.76 160.94 1.81 Allowed 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 123.309 2.673 . . . . 0.63 113.388 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 31.6 p -86.11 -39.82 16.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.665 0.745 . . . . 0.73 109.096 174.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.538 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 89.2 t80 -124.02 128.19 48.99 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.883 -1.053 . . . . 0.76 109.395 176.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.487 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 2.7 tm? -140.57 115.79 9.91 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.174 -0.676 . . . . 1.55 109.174 -178.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -130.37 132.43 45.8 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.832 0.348 . . . . 2.23 111.437 -177.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.8 mp -108.52 115.7 30.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.986 -0.552 . . . . 1.72 109.855 172.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.492 HG23 ' HB3' ' A' ' 56' ' ' ASP . 11.0 m -106.48 149.42 9.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.344 -0.389 . . . . 1.08 110.813 177.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -64.44 120.02 11.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.602 -0.726 . . . . 1.83 110.046 176.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.3 tttp . . . . . 0 C--N 1.318 -0.766 0 N-CA-C 108.885 -0.783 . . . . 2.76 108.885 178.392 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.9 m . . . . . 0 N--CA 1.452 -0.327 0 N-CA-C 109.19 -0.67 . . . . 1.71 109.19 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -131.49 147.4 52.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.043 0.449 . . . . 1.15 111.74 -172.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.492 ' HB3' HG23 ' A' ' 45' ' ' VAL . 5.6 t70 -110.4 119.03 37.91 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.343 -0.984 . . . . 1.35 108.343 173.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -107.03 123.02 47.59 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.117 0.484 . . . . 0.51 111.786 -175.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.8 t -94.41 111.45 25.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.678 -0.692 . . . . 0.55 109.203 174.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.579 HG23 ' HA ' ' A' ' 94' ' ' CYS . 0.0 OUTLIER -108.97 115.66 50.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 121.562 0.696 . . . . 1.18 110.636 -178.111 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.538 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 85.3 t -112.3 106.17 20.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.025 -0.989 . . . . 0.58 109.029 176.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.506 ' HB3' HD11 ' A' ' 59' ' ' ILE . 29.8 t -145.04 154.8 42.9 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.413 0.523 . . . . 0.84 112.413 -172.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.738 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 0.9 OUTLIER -66.87 -19.48 65.74 Favored 'General case' 0 C--O 1.221 -0.419 0 CA-C-N 115.334 -0.848 . . . . 1.67 110.742 171.894 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -69.27 2.17 3.14 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.088 0.471 . . . . 1.81 111.028 -178.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -124.59 4.25 8.26 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.754 0.312 . . . . 3.19 111.126 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.738 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.2 OUTLIER -74.88 -9.6 58.7 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 121.892 -0.505 . . . . 2.14 111.636 -176.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.6 p-10 -87.44 -9.98 53.17 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.968 0.414 . . . . 2.03 109.995 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.8 ttpp 64.67 25.14 13.04 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.174 -0.921 . . . . 3.31 111.32 173.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.536 ' HE3' HD11 ' A' ' 70' ' ' LEU . 30.4 mmmt -94.67 89.83 5.89 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.358 0.599 . . . . 1.99 109.617 176.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.471 HD12 ' N ' ' A' ' 70' ' ' LEU . 4.0 pp -69.19 -30.31 68.47 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.763 -0.653 . . . . 2.33 110.994 -174.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.536 HD11 ' HE3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -67.32 -33.88 76.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.651 0.263 . . . . 1.09 110.573 177.204 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.5 ' N ' HD22 ' A' ' 70' ' ' LEU . 25.5 t70 -74.22 -40.21 62.6 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.676 -0.49 . . . . 2.08 109.676 178.188 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -59.11 -44.44 91.99 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.425 -0.583 . . . . 2.93 109.425 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -57.7 -55.25 37.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.662 -0.699 . . . . 1.21 111.255 178.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.458 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 2.3 ptm180 -61.5 -41.51 97.39 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 111.784 0.29 . . . . 1.67 111.784 -175.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.5 mt -64.18 -50.88 66.39 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.883 0.373 . . . . 1.48 110.786 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.412 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 54.1 t -56.28 -45.7 81.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.84 -0.618 . . . . 0.82 110.92 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -64.36 -31.29 72.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.633 -0.258 . . . . 1.14 111.413 -178.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 85.2 m -66.03 -49.32 68.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.572 -0.286 . . . . 0.69 111.408 -178.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.1 mp -79.45 -46.0 23.27 Favored 'Isoleucine or valine' 0 C--O 1.242 0.666 0 CA-C-O 121.364 0.602 . . . . 0.77 110.701 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.838 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.8 mp -73.15 -5.46 39.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.074 -0.512 . . . . 0.78 111.711 -175.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -49.46 -63.94 0.95 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.215 -0.291 . . . . 1.93 110.215 171.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.472 ' O ' ' HG2' ' A' ' 85' ' ' GLN . 6.0 tp10 -75.1 -37.6 61.45 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.264 0.554 . . . . 2.91 110.507 175.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.838 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 3.8 tp10 -53.01 -55.15 25.78 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.412 -0.813 . . . . 1.66 112.603 -174.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.652 ' HG ' ' HB3' ' A' ' 80' ' ' LEU . 55.3 mt -50.4 -30.53 12.62 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.846 -1.07 . . . . 0.58 113.386 -176.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.472 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 19.5 mm-40 -51.16 -27.35 8.44 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.018 0.372 . . . . 0.92 111.67 -176.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.544 ' HB3' HD11 ' A' ' 25' ' ' ILE . 44.5 m-80 -77.74 -24.82 48.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.386 -0.37 . . . . 1.02 111.337 -178.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.438 HD11 HG21 ' A' ' 29' ' ' ILE . 1.8 mt -103.64 156.87 5.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.451 -0.574 . . . . 0.77 109.451 -176.265 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 39.4 t60 -98.46 -36.73 9.85 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.548 -0.461 . . . . 1.85 110.173 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -147.54 96.84 2.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.118 -0.492 . . . . 0.78 110.679 178.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -101.09 136.09 41.49 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.174 -0.466 . . . . 0.63 110.887 178.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 33.0 t -125.76 152.51 45.28 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.111 -0.7 . . . . 1.27 109.111 177.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -143.39 134.72 26.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.306 0.574 . . . . 0.64 111.505 -177.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -117.42 109.28 16.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.646 -0.706 . . . . 2.23 109.412 174.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.579 ' HA ' HG23 ' A' ' 59' ' ' ILE . 7.5 p -92.77 130.62 38.32 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.276 0.56 . . . . 1.38 111.555 -176.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.414 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 40.3 m80 -143.88 167.08 23.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.586 -0.733 . . . . 1.98 110.017 178.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 39.1 p -101.63 159.15 30.26 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 116.238 -0.437 . . . . 0.76 110.006 176.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -58.68 -29.44 89.43 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.252 1.968 . . . . 0.72 111.166 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.85 -45.48 70.97 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.542 -0.754 . . . . 2.08 109.781 177.129 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.483 ' HA ' ' CE ' ' A' ' 102' ' ' LYS . 8.5 tp10 -61.95 -42.55 99.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.044 0.449 . . . . 2.69 110.284 177.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -64.66 -32.53 74.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.683 -0.689 . . . . 1.46 110.429 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -59.45 -36.49 76.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.052 -0.522 . . . . 1.23 111.266 -178.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.483 ' CE ' ' HA ' ' A' ' 99' ' ' GLU . 0.0 OUTLIER -63.64 -44.66 93.19 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.962 -0.295 . . . . 2.66 110.518 176.592 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 51.7 mt . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 116.177 -0.465 . . . . 1.31 110.948 -176.543 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 33.7 m . . . . . 0 C--O 1.235 0.34 0 N-CA-C 110.126 -0.324 . . . . 1.71 110.126 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.9 tp -56.1 -35.62 42.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 O-C-N 123.075 0.235 . . . . 1.37 110.893 -178.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.52 HE21 ' HG ' ' A' ' 44' ' ' LEU . 39.0 tt0 -53.27 -49.98 65.8 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.86 0.362 . . . . 1.75 110.763 175.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.456 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 70.3 mmtt -71.32 -23.89 62.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.965 -0.562 . . . . 2.5 112.187 -174.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 46.4 t -67.22 -52.21 45.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-O 121.163 0.506 . . . . 1.04 109.844 176.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.416 HG13 ' OE1' ' A' ' 83' ' ' GLU . 1.8 mp -60.42 -48.56 87.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.413 -0.812 . . . . 0.79 109.905 175.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -56.4 -49.71 73.72 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.086 -0.961 . . . . 2.2 111.117 -178.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -56.33 -50.74 70.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.146 -0.479 . . . . 1.67 111.767 -177.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.3 mtmp? -63.28 -46.83 84.94 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.415 0.524 . . . . 2.03 112.415 -175.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.447 HD12 ' N ' ' A' ' 34' ' ' SER . 4.3 pp -71.42 -28.83 64.27 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.24 -0.584 . . . . 0.57 110.848 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.447 ' N ' HD12 ' A' ' 33' ' ' LEU . 23.1 t -69.21 -36.93 77.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.931 0.396 . . . . 1.29 110.149 177.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.1 m -71.6 -28.0 63.51 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.409 -0.359 . . . . 0.78 111.189 178.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.09 -54.92 5.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.313 -0.403 . . . . 0.64 112.005 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.6 mp -88.86 -25.68 22.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.601 0.238 . . . . 0.94 110.639 -177.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.459 ' HE2' ' HB2' ' A' ' 38' ' ' LYS . 19.9 ttmm 59.82 78.18 0.35 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.56 -0.746 . . . . 3.36 111.373 177.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.847 ' HA ' ' HB3' ' A' ' 61' ' ' SER . 97.4 Cg_endo -93.0 157.93 2.68 Favored 'Trans proline' 0 N--CA 1.451 -1.024 0 C-N-CA 123.177 2.585 . . . . 0.63 113.167 -177.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.0 p -89.65 -28.05 19.74 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.813 -0.63 . . . . 0.73 109.826 175.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.431 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 83.4 t80 -138.3 139.77 39.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.687 -0.688 . . . . 0.76 110.13 178.233 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.631 HD22 ' HA ' ' A' ' 59' ' ' ILE . 0.2 OUTLIER -142.21 116.36 9.45 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.228 -0.656 . . . . 1.55 109.228 179.135 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -114.54 127.78 55.98 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.947 0.403 . . . . 2.23 110.263 177.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.52 ' HG ' HE21 ' A' ' 26' ' ' GLN . 3.7 mm? -98.94 115.79 29.7 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.765 -0.652 . . . . 1.72 110.214 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.534 ' HB ' ' HB3' ' A' ' 56' ' ' ASP . 29.6 t -103.49 146.22 11.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.453 -0.794 . . . . 1.08 109.32 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -69.79 129.87 40.75 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.832 -0.433 . . . . 1.83 109.832 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.682 ' HA ' ' HE3' ' A' ' 47' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.478 0 CA-C-O 121.047 0.451 . . . . 2.76 110.044 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.0 p . . . . . 0 N--CA 1.454 -0.268 0 N-CA-C 110.288 -0.264 . . . . 1.71 110.288 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -128.3 152.45 48.12 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.251 0.548 . . . . 1.15 111.652 -175.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.534 ' HB3' ' HB ' ' A' ' 45' ' ' VAL . 13.7 t70 -113.67 134.2 54.87 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.232 -1.025 . . . . 1.35 108.232 174.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -125.31 120.99 32.71 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.279 0.561 . . . . 0.51 112.378 -174.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.3 t -92.52 110.98 23.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.484 -0.78 . . . . 0.55 108.996 171.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.631 ' HA ' HD22 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -105.4 120.47 56.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.252 -0.431 . . . . 1.18 110.576 -176.899 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.482 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 58.1 t -115.79 106.92 21.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.73 -0.668 . . . . 0.58 110.373 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.847 ' HB3' ' HA ' ' A' ' 39' ' ' PRO . 86.9 p -153.37 153.09 31.9 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.884 0.374 . . . . 0.84 111.048 -179.019 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.851 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 23.9 m-80 -67.17 -19.35 65.57 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.122 -0.49 . . . . 1.67 112.078 175.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -52.5 -25.43 10.25 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.868 -0.52 . . . . 1.81 111.505 -177.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -100.37 -1.34 36.28 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.685 0.624 . . . . 3.19 112.685 -174.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.851 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -72.98 -15.59 61.54 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.542 -0.724 . . . . 2.14 111.669 -178.938 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -80.18 5.25 14.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.136 0.493 . . . . 2.03 110.317 -178.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt 62.58 26.74 15.86 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.355 -0.839 . . . . 3.31 110.803 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.615 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 71.0 mmtt -83.77 97.9 9.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.912 -0.586 . . . . 1.99 111.799 -177.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -73.69 -44.11 57.45 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 115.404 -0.817 . . . . 2.33 108.906 175.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.485 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.74 -33.17 74.34 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.012 -0.54 . . . . 1.09 111.503 -178.042 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.615 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 30.6 t70 -66.82 -50.29 63.08 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 109.749 -0.463 . . . . 2.08 109.749 177.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -57.42 -43.64 83.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.74 -0.664 . . . . 2.93 109.591 176.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -61.45 -50.94 70.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.658 -0.701 . . . . 1.21 111.708 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.07 -35.81 66.74 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.072 -0.251 . . . . 1.67 111.319 -174.358 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.0 mp -64.3 -50.09 69.21 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.792 0.33 . . . . 1.48 110.801 177.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.799 HG13 HD22 ' A' ' 80' ' ' LEU . 42.0 t -58.73 -47.52 88.77 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.4 0 CA-C-N 116.048 -0.524 . . . . 0.82 110.976 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.441 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 13.2 m-80 -62.47 -38.26 89.15 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.905 -0.318 . . . . 1.14 111.702 -178.255 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 87.6 m -61.4 -57.87 10.5 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.06 0.393 . . . . 0.69 112.06 -177.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.402 ' N ' HD12 ' A' ' 79' ' ' ILE . 3.7 mp -81.37 -46.09 20.47 Favored 'Isoleucine or valine' 0 C--O 1.239 0.522 0 CA-C-O 121.457 0.646 . . . . 0.77 110.839 -175.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.869 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.6 mp -74.55 -5.35 42.32 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.867 -0.606 . . . . 0.78 111.504 -175.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 20.5 tptm -49.73 -63.64 1.05 Allowed 'General case' 0 C--O 1.227 -0.117 0 N-CA-C 109.772 -0.455 . . . . 1.93 109.772 169.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -75.2 -30.19 60.57 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.294 0.569 . . . . 2.91 110.322 179.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.869 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 6.7 tp10 -56.8 -55.59 32.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.553 -0.748 . . . . 1.66 112.001 -179.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.658 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 75.0 mt -50.37 -30.77 13.0 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.173 -0.921 . . . . 0.58 112.634 -178.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 22.2 mm-40 -52.76 -30.76 34.62 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 120.954 0.407 . . . . 0.92 111.163 -176.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -96.57 5.36 50.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.199 -0.455 . . . . 1.02 111.395 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 9.1 mt -122.89 136.62 59.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.507 -0.315 . . . . 0.77 110.285 -178.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -73.38 -38.68 65.58 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.939 0.399 . . . . 1.85 110.226 179.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.32 102.0 1.09 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.899 -0.592 . . . . 0.78 110.416 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -94.64 140.22 30.16 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.388 -0.369 . . . . 0.63 110.221 177.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.8 m -128.83 140.19 51.82 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.335 -0.617 . . . . 1.27 109.335 176.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -129.71 133.3 46.97 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.149 0.5 . . . . 0.64 110.909 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 42.1 tptt -124.34 116.36 22.47 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.996 -0.547 . . . . 2.23 109.927 174.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.559 ' HA ' HG23 ' A' ' 59' ' ' ILE . 65.9 m -89.22 134.37 34.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.835 -0.621 . . . . 1.38 111.753 -173.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.482 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 55.9 m-70 -136.84 153.48 50.77 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.187 -0.915 . . . . 1.98 109.393 175.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.45 HG21 ' HB3' ' A' ' 65' ' ' GLU . 0.6 OUTLIER -93.54 150.71 39.31 Favored Pre-proline 0 C--N 1.314 -0.958 0 CA-C-N 116.282 -0.417 . . . . 0.76 110.173 174.579 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . 0.536 ' HG2' ' ND2' ' A' ' 62' ' ' ASN . 50.3 Cg_exo -57.09 -31.85 91.54 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.707 2.271 . . . . 0.72 112.072 -179.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.406 ' O ' ' HE3' ' A' ' 102' ' ' LYS . 3.1 mm? -67.64 -50.86 55.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.528 -0.76 . . . . 2.08 110.229 176.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.67 -27.31 66.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.541 -0.299 . . . . 2.69 111.636 -178.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -73.77 -32.69 63.92 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.766 -0.457 . . . . 1.46 109.766 173.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -59.5 -42.64 92.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.809 -0.632 . . . . 1.23 109.855 177.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.406 ' HE3' ' O ' ' A' ' 98' ' ' LEU . 0.0 OUTLIER -56.8 -32.57 65.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.899 -0.591 . . . . 2.66 110.985 177.12 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 70.2 mt . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 1.31 112.088 -176.248 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.511 ' O ' HG23 ' A' ' 28' ' ' VAL . 48.2 t . . . . . 0 N--CA 1.453 -0.311 0 N-CA-C 107.85 -1.167 . . . . 1.71 107.85 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 7.0 tp -59.08 -38.7 75.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.106 0.479 . . . . 1.37 110.218 177.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -63.4 -39.27 94.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.912 -0.586 . . . . 1.75 110.165 176.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -69.66 -33.83 73.14 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.98 -0.555 . . . . 2.5 110.782 -179.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 24' ' ' CYS . 94.8 t -57.61 -53.02 50.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 110.202 -0.296 . . . . 1.04 110.202 176.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.9 mp -68.08 -45.35 83.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.244 -0.434 . . . . 0.79 111.181 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -61.38 -52.27 65.31 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.648 0.261 . . . . 2.2 110.934 -176.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -69.56 -27.17 64.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.491 -0.322 . . . . 1.67 110.786 -176.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.403 ' HE2' ' HB3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -62.61 -55.65 25.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.189 -0.46 . . . . 2.03 111.172 178.489 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.431 HD12 ' N ' ' A' ' 34' ' ' SER . 3.8 pp -74.26 -30.11 61.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.538 -0.301 . . . . 0.57 111.135 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.431 ' N ' HD12 ' A' ' 33' ' ' LEU . 23.1 t -63.9 -51.59 63.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.419 -0.355 . . . . 1.29 110.837 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.0 m -71.27 -27.23 63.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.568 -0.287 . . . . 0.78 111.284 -177.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.28 -53.89 7.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.522 -0.308 . . . . 0.64 111.678 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.4 mt -83.49 -34.97 25.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.525 -0.307 . . . . 0.94 111.344 -176.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.4 mttp 62.83 85.71 0.16 Allowed Pre-proline 0 N--CA 1.464 0.233 0 CA-C-N 115.636 -0.711 . . . . 3.36 111.927 -177.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.419 ' HG2' ' HB2' ' A' ' 42' ' ' LEU . 94.4 Cg_endo -94.49 157.89 1.98 Allowed 'Trans proline' 0 N--CA 1.45 -1.067 0 C-N-CA 123.164 2.576 . . . . 0.63 112.162 175.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 21.5 p -78.81 -29.48 44.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.413 0.625 . . . . 0.73 109.539 176.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.491 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 82.9 t80 -141.68 134.49 28.7 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.068 -0.969 . . . . 0.76 109.841 175.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.419 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 1.2 tm? -140.63 112.72 7.75 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.024 -0.732 . . . . 1.55 109.024 178.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -113.37 122.32 47.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.76 -0.459 . . . . 2.23 109.76 177.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.457 HD11 ' HB3' ' A' ' 55' ' ' PHE . 0.1 OUTLIER -97.97 115.36 28.01 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.618 -0.512 . . . . 1.72 109.618 179.727 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 39.0 t -112.93 135.34 52.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 116.594 -0.276 . . . . 1.08 110.81 -176.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -67.72 112.86 5.05 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.211 -0.663 . . . . 1.83 109.211 171.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.422 ' HB3' ' OG ' ' A' ' 54' ' ' SER . 56.4 tttp . . . . . 0 C--N 1.319 -0.753 0 CA-C-N 115.784 -0.644 . . . . 2.76 110.787 -173.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.422 ' OG ' ' HB3' ' A' ' 47' ' ' LYS . 32.6 t . . . . . 0 N--CA 1.447 -0.611 0 N-CA-C 109.06 -0.718 . . . . 1.71 109.06 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.457 ' HB3' HD11 ' A' ' 44' ' ' LEU . 41.9 m-85 -124.67 132.62 53.39 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.858 0.361 . . . . 1.15 111.268 -172.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -115.46 114.46 25.07 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 107.423 -1.325 . . . . 1.35 107.423 171.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.05 117.76 34.88 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.026 0.441 . . . . 0.51 111.523 -172.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.8 t -80.4 110.78 16.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 108.985 -0.746 . . . . 0.55 108.985 173.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -112.65 112.6 41.14 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.663 0.744 . . . . 1.18 110.376 -176.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.528 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 75.3 t -110.26 108.72 26.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.082 -0.963 . . . . 0.58 108.931 175.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.1 t -149.04 155.04 40.17 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.359 0.6 . . . . 0.84 112.402 -172.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -66.99 -19.44 65.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 114.922 -1.035 . . . . 1.67 111.602 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 35.0 p30 -68.33 -25.39 65.09 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.852 -0.339 . . . . 1.81 111.244 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.489 ' HD2' HG23 ' A' ' 96' ' ' THR . 57.6 t80 -85.72 -12.78 50.28 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.454 0.645 . . . . 3.19 109.723 176.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.47 -24.64 34.14 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.299 -0.864 . . . . 2.14 109.027 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -67.49 -21.25 65.52 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.325 -0.852 . . . . 2.03 109.065 173.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt 65.06 23.66 12.47 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.005 -0.998 . . . . 3.31 110.966 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -90.74 89.82 7.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.956 -0.566 . . . . 1.99 110.098 177.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.4 tt -61.65 -49.83 74.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.437 -0.801 . . . . 2.33 110.733 -175.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.416 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -63.49 -31.66 72.89 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.716 0.265 . . . . 1.09 111.716 -178.586 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.65 ' O ' ' HG2' ' A' ' 74' ' ' ARG . 12.4 m-20 -73.98 -46.23 45.13 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.113 -0.235 . . . . 2.08 111.42 -179.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.406 ' O ' HG23 ' A' ' 76' ' ' VAL . 0.0 OUTLIER -67.3 -26.68 66.64 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.391 -0.524 . . . . 2.93 109.92 176.479 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -70.94 -48.01 55.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.066 -0.516 . . . . 1.21 110.473 176.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.65 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 7.7 ptm180 -63.69 -34.69 78.42 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.524 -0.307 . . . . 1.67 110.759 -178.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 95.3 mt -68.03 -50.12 57.3 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.378 -0.374 . . . . 1.48 110.2 177.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.582 HG13 HD22 ' A' ' 80' ' ' LEU . 43.5 t -57.4 -41.34 78.34 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 CA-C-N 116.019 -0.537 . . . . 0.82 110.781 178.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -62.15 -45.74 92.06 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.775 0.321 . . . . 1.14 111.203 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 59.1 m -65.52 -45.86 81.84 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.038 0.447 . . . . 0.69 111.361 -175.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 47.3 mt -77.46 -50.68 19.84 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 CA-C-O 121.464 0.65 . . . . 0.77 110.985 -176.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.855 ' HA ' ' CB ' ' A' ' 83' ' ' GLU . 9.7 mp -77.27 -3.97 42.53 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.636 -0.711 . . . . 0.78 111.903 -173.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.2 tptt -52.35 -63.68 1.06 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.601 -0.518 . . . . 1.93 109.601 172.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -75.53 -30.56 59.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.438 -0.347 . . . . 2.91 111.243 174.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.855 ' CB ' ' HA ' ' A' ' 80' ' ' LEU . 2.6 tp10 -54.28 -54.7 36.67 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.048 0.451 . . . . 1.66 111.585 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 66.0 mt -50.34 -30.86 13.09 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.203 -0.908 . . . . 0.58 112.317 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -54.19 -28.14 38.64 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.757 0.313 . . . . 0.92 111.128 -177.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -90.34 -6.89 54.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.869 0.366 . . . . 1.02 111.136 -178.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.531 HG21 ' HB2' ' A' ' 90' ' ' PHE . 4.2 mt -114.9 146.49 19.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.297 -0.411 . . . . 0.77 109.944 -175.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 60.9 t60 -95.01 -28.7 14.99 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.848 0.356 . . . . 1.85 110.079 176.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -158.68 95.58 1.32 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.18 -0.464 . . . . 0.78 110.994 178.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . 0.531 ' HB2' HG21 ' A' ' 87' ' ' ILE . 81.9 t80 -99.39 144.5 28.43 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.222 -0.445 . . . . 0.63 110.702 176.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 51.1 m -142.82 147.45 35.47 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.458 -0.571 . . . . 1.27 109.458 173.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -115.19 137.15 52.34 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.279 0.561 . . . . 0.64 111.248 -177.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -111.62 108.84 18.46 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 107.955 -1.128 . . . . 2.23 107.955 175.229 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 6.3 p -100.1 128.57 46.16 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.414 0.524 . . . . 1.38 112.414 -169.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.528 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 44.5 m80 -141.58 159.79 41.49 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-O 121.543 0.687 . . . . 1.98 111.52 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.489 HG23 ' HD2' ' A' ' 64' ' ' PHE . 0.6 OUTLIER -103.28 149.6 37.12 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 114.932 -1.031 . . . . 0.76 110.67 177.362 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . 0.528 ' HA ' ' HB3' ' A' ' 100' ' ' TYR . 22.2 Cg_endo -61.79 -24.81 77.85 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.838 2.359 . . . . 0.72 112.876 -178.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.429 HD22 ' HA ' ' A' ' 98' ' ' LEU . 0.3 OUTLIER -61.87 -51.41 68.33 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.803 -0.443 . . . . 2.08 109.803 179.047 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 19.7 mp0 -72.77 -33.36 66.26 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.084 -0.507 . . . . 2.69 111.118 177.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.528 ' HB3' ' HA ' ' A' ' 97' ' ' PRO . 50.0 t80 -58.65 -39.84 81.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.428 -0.351 . . . . 1.46 111.241 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -57.16 -36.1 70.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.997 0.427 . . . . 1.23 110.657 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.712 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.5 OUTLIER -70.44 -35.76 73.55 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.191 -0.459 . . . . 2.66 110.396 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 86.3 mt . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 1.31 111.12 -178.773 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.525 ' O ' HG23 ' A' ' 28' ' ' VAL . 53.3 t . . . . . 0 N--CA 1.456 -0.146 0 N-CA-C 110.523 -0.177 . . . . 1.71 110.523 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.9 tp -52.54 -31.99 16.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 O-C-N 123.642 0.589 . . . . 1.37 111.714 -177.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -60.64 -54.87 40.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.903 0.382 . . . . 1.75 110.101 176.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.1 tttp -71.98 -21.8 61.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.155 -0.475 . . . . 2.5 111.495 -178.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.525 HG23 ' O ' ' A' ' 24' ' ' CYS . 72.9 t -59.64 -45.26 94.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 109.644 -0.502 . . . . 1.04 109.644 174.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.12 -41.17 88.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.945 -0.571 . . . . 0.79 110.102 175.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 34' ' ' SER . 68.7 mt-10 -53.76 -52.22 60.88 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.22 -0.446 . . . . 2.2 111.037 178.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -75.43 -30.9 60.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.977 -0.556 . . . . 1.67 110.919 -174.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -60.68 -52.56 64.63 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.273 -0.421 . . . . 2.03 110.718 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -74.23 -26.03 60.01 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.847 -0.341 . . . . 0.57 110.699 178.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 30' ' ' GLU . 12.4 t -67.49 -39.19 85.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.321 -0.399 . . . . 1.29 110.413 179.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.0 m -71.33 -27.27 63.27 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.879 0.371 . . . . 0.78 110.973 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.43 -45.22 10.72 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.188 0.44 . . . . 0.64 112.188 -175.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 86.3 mt -95.63 -21.96 17.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.676 0.274 . . . . 0.94 111.391 -176.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt 56.11 80.42 0.29 Allowed Pre-proline 0 C--N 1.329 -0.317 0 C-N-CA 123.399 0.68 . . . . 3.36 112.116 -178.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -92.92 138.98 1.64 Allowed 'Trans proline' 0 N--CA 1.446 -1.294 0 C-N-CA 122.938 2.425 . . . . 0.63 111.684 171.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 13.5 p -75.7 -26.86 57.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.225 0.536 . . . . 0.73 109.808 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.485 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 88.2 t80 -140.87 137.35 33.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.338 -0.846 . . . . 0.76 109.757 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 48.4 tp -136.27 117.14 14.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.34 -0.391 . . . . 1.55 110.338 178.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.47 ' HB2' ' CE2' ' A' ' 41' ' ' PHE . 40.5 tt0 -112.63 115.23 28.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.161 -0.472 . . . . 2.23 110.502 -178.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -94.28 117.12 29.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 1.72 110.101 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 57.2 t -120.37 127.9 75.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.113 -0.494 . . . . 1.08 111.08 -178.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -75.77 101.36 5.04 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.374 0.607 . . . . 1.83 109.41 172.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.434 ' HE3' ' HB2' ' A' ' 47' ' ' LYS . 20.7 ttmt . . . . . 0 C--N 1.319 -0.729 0 CA-C-N 115.57 -0.741 . . . . 2.76 110.012 -175.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.427 ' HA ' ' O ' ' A' ' 89' ' ' ALA . 26.6 p . . . . . 0 N--CA 1.45 -0.432 0 CA-C-O 120.994 0.426 . . . . 1.71 111.891 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -111.57 135.97 51.42 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.913 -0.585 . . . . 1.15 109.533 174.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -119.27 118.38 31.1 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.449 -0.575 . . . . 1.35 109.449 179.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -109.79 122.77 48.25 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.053 0.454 . . . . 0.51 111.767 -174.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.401 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 61.3 t -91.57 111.64 24.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.746 -0.661 . . . . 0.55 109.265 174.132 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.472 ' CG1' ' HA ' ' A' ' 94' ' ' CYS . 1.4 pp -99.25 138.12 24.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.388 -0.369 . . . . 1.18 110.358 -176.394 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.485 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 66.0 t -124.76 99.76 6.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 108.999 -0.741 . . . . 0.58 108.999 174.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 31.4 t -139.25 148.19 42.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.053 0.454 . . . . 0.84 111.8 -174.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.453 ' ND2' ' HG2' ' A' ' 97' ' ' PRO . 0.9 OUTLIER -67.66 -19.09 65.16 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.537 -0.756 . . . . 1.67 111.033 174.164 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -56.1 -40.0 73.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.817 0.342 . . . . 1.81 111.908 -175.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -94.25 5.24 52.38 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.942 0.349 . . . . 3.19 111.942 -171.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.44 -14.6 60.86 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.873 -0.517 . . . . 2.14 110.318 -178.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.546 ' OD2' ' HG2' ' A' ' 68' ' ' LYS . 23.1 t70 -81.27 -12.54 59.06 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.673 -0.694 . . . . 2.03 109.793 174.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt 67.79 35.96 3.72 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.195 -0.911 . . . . 3.31 110.731 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.892 ' HB3' ' HB2' ' A' ' 71' ' ' ASP . 32.2 mmtm -72.6 95.9 1.9 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.059 -0.519 . . . . 1.99 111.225 177.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.44 ' O ' ' HG3' ' A' ' 72' ' ' ARG . 2.8 tm? -73.71 -47.32 40.36 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.759 -0.46 . . . . 2.33 109.759 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.458 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.28 -32.09 72.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.275 -0.421 . . . . 1.09 111.253 -177.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.892 ' HB2' ' HB3' ' A' ' 68' ' ' LYS . 3.6 m-20 -73.94 -42.52 60.42 Favored 'General case' 0 CA--C 1.52 -0.209 0 C-N-CA 120.976 -0.29 . . . . 2.08 111.285 179.034 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.465 ' HE ' ' C ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -63.91 -28.32 69.75 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 120.128 -0.629 . . . . 2.93 109.589 178.168 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 75.9 t60 -65.36 -58.88 4.79 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.19 -0.459 . . . . 1.21 110.064 176.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.526 ' HD3' ' OD1' ' A' ' 71' ' ' ASP . 5.6 ptm180 -63.91 -41.6 97.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.019 -0.537 . . . . 1.67 111.616 -175.099 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 89.2 mt -66.54 -51.39 57.08 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.631 0.253 . . . . 1.48 110.866 -177.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.863 HG13 HD22 ' A' ' 80' ' ' LEU . 25.3 t -58.49 -44.94 90.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.439 . . . . 0.82 111.171 -179.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.506 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 13.5 m120 -63.61 -43.11 97.86 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.714 -0.394 . . . . 1.14 111.277 -177.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 35.0 m -67.85 -40.99 83.61 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.138 0.422 . . . . 0.69 112.138 -174.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.573 HG22 ' OE2' ' A' ' 83' ' ' GLU . 17.1 mt -90.07 -52.19 10.96 Favored 'Isoleucine or valine' 0 C--O 1.25 1.106 0 CA-C-O 122.011 0.91 . . . . 0.77 110.826 -175.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.863 HD22 HG13 ' A' ' 76' ' ' VAL . 9.7 mp -67.68 -9.85 47.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.352 -0.84 . . . . 0.78 110.477 -179.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.506 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 55.5 tptt -47.07 -56.84 5.81 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 109.592 -0.522 . . . . 1.93 109.592 165.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.581 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 43.7 mt-10 -74.99 -30.56 61.2 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.078 -0.51 . . . . 2.91 111.253 -179.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.595 ' HB2' ' HA ' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -52.56 -56.09 17.69 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 122.353 1.073 . . . . 1.66 110.91 173.764 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.779 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 32.9 mt -50.5 -30.69 13.43 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 112.94 -1.936 . . . . 0.58 112.906 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.581 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 26.1 mm-40 -59.12 -23.63 62.3 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 120.55 -0.46 . . . . 0.92 110.54 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 -102.28 -23.23 14.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.126 -0.488 . . . . 1.02 111.154 -178.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.9 mt -110.3 133.87 54.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.757 0.313 . . . . 0.77 111.03 -174.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 39.1 t60 -72.03 -43.34 65.13 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.853 0.359 . . . . 1.85 110.201 178.108 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.427 ' O ' ' HA ' ' A' ' 54' ' ' SER . . . -145.5 105.03 3.97 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.959 0.409 . . . . 0.78 110.862 178.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -105.37 132.83 51.06 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.0 0.429 . . . . 0.63 110.672 176.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.9 m -123.77 145.96 48.66 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.921 -0.581 . . . . 1.27 109.445 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -132.27 138.65 47.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.299 0.571 . . . . 0.64 111.499 -176.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -109.34 109.22 20.04 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.491 -0.777 . . . . 2.23 109.282 172.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.472 ' HA ' ' CG1' ' A' ' 59' ' ' ILE . 9.0 p -83.34 99.81 10.26 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.967 -0.561 . . . . 1.38 110.336 -176.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.5 m170 -118.45 163.01 17.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.452 0.644 . . . . 1.98 111.423 -178.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.97 156.32 50.26 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 115.275 -0.875 . . . . 0.76 110.732 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . 0.453 ' HG2' ' ND2' ' A' ' 62' ' ' ASN . 35.0 Cg_exo -58.63 -27.88 84.34 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.947 2.431 . . . . 0.72 112.823 -177.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.51 -51.21 70.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.977 0.418 . . . . 2.08 109.999 178.537 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.504 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 11.4 mp0 -65.6 -43.68 88.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.907 -0.588 . . . . 2.69 110.666 178.164 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -59.43 -37.39 77.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.095 -0.502 . . . . 1.46 110.938 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -57.9 -34.59 69.99 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.298 0.571 . . . . 1.23 110.503 178.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.639 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -78.89 -44.97 21.59 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.5 -0.773 . . . . 2.66 110.466 176.678 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 86.4 mt . . . . . 0 N--CA 1.464 0.259 0 CA-C-N 116.032 -0.531 . . . . 1.31 111.894 -176.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 67.8 m . . . . . 0 C--O 1.238 0.469 0 CA-C-O 121.15 0.5 . . . . 1.71 111.236 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 11.9 tt -67.15 -35.87 75.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.914 -0.584 . . . . 1.37 111.325 -177.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -62.12 -36.62 82.31 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 120.743 -0.383 . . . . 1.75 110.128 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.408 ' HD3' ' HB2' ' A' ' 31' ' ' ASP . 15.7 tppt? -65.63 -44.66 85.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.382 -0.372 . . . . 2.5 110.489 178.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.0 t -54.59 -54.31 23.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 CA-C-O 120.865 0.364 . . . . 1.04 110.93 178.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.438 HG13 ' OE1' ' A' ' 83' ' ' GLU . 1.8 mp -61.88 -54.64 31.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.029 -0.532 . . . . 0.79 110.992 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -55.41 -52.44 63.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.025 -0.534 . . . . 2.2 111.801 -174.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.408 ' HB2' ' HD3' ' A' ' 27' ' ' LYS . 0.7 OUTLIER -75.04 -28.54 60.46 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.675 -0.41 . . . . 1.67 111.381 -170.613 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.1 ttpm? -67.95 -48.13 66.74 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.615 -0.434 . . . . 2.03 110.665 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.405 HD12 ' N ' ' A' ' 34' ' ' SER . 4.4 pp -72.99 -29.64 63.2 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.781 -0.368 . . . . 0.57 110.944 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.405 ' N ' HD12 ' A' ' 33' ' ' LEU . 66.0 m -70.44 -34.8 72.88 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 116.574 -0.284 . . . . 1.29 111.058 178.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 56.4 m -71.59 -27.4 63.1 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.786 0.327 . . . . 0.78 111.2 177.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.7 -49.68 15.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.282 -0.417 . . . . 0.64 111.739 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 91.0 mt -84.15 -31.66 25.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.859 0.361 . . . . 0.94 110.401 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.471 ' HA ' ' HD2' ' A' ' 38' ' ' LYS . 41.5 tptt 55.57 88.46 0.12 Allowed Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 114.959 -1.019 . . . . 3.36 111.695 -176.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.897 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 97.4 Cg_endo -89.18 137.87 3.21 Favored 'Trans proline' 0 N--CA 1.451 -0.997 0 C-N-CA 122.743 2.295 . . . . 0.63 112.606 179.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.4 p -69.91 -29.85 67.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.452 0.644 . . . . 0.73 109.735 173.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.779 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 90.8 t80 -140.74 127.94 20.96 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.173 -0.921 . . . . 0.76 109.112 175.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.415 HD22 ' HA ' ' A' ' 42' ' ' LEU . 1.2 tm? -136.28 126.05 25.62 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.518 -0.549 . . . . 1.55 109.518 -178.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -129.64 127.84 41.41 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.735 -0.468 . . . . 2.23 109.735 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -94.99 115.75 27.83 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.78 -0.452 . . . . 1.72 109.78 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 60.8 t -103.44 121.76 55.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-N 116.041 -0.527 . . . . 1.08 110.395 -177.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -68.48 111.15 4.52 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.981 -0.554 . . . . 1.83 109.667 177.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.715 ' HD3' ' HB2' ' A' ' 56' ' ' ASP . 18.5 tptt . . . . . 0 N--CA 1.447 -0.578 0 N-CA-C 108.883 -0.784 . . . . 2.76 108.883 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.426 ' OG ' ' HB3' ' A' ' 47' ' ' LYS . 12.3 p . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 120.782 0.325 . . . . 1.71 110.963 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -127.4 133.53 49.99 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.323 -0.398 . . . . 1.15 110.818 -178.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.715 ' HB2' ' HD3' ' A' ' 47' ' ' LYS . 27.7 t0 -112.34 115.67 29.13 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.697 -0.853 . . . . 1.35 108.697 177.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.85 119.53 39.39 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.208 0.528 . . . . 0.51 111.738 -171.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 48.4 t -84.27 111.32 19.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.646 -0.706 . . . . 0.55 109.33 176.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.499 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -107.52 109.29 27.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.712 0.767 . . . . 1.18 110.45 -176.818 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.779 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 97.3 t -106.88 108.66 25.72 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 114.929 -1.032 . . . . 0.58 109.024 175.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.897 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 31.2 t -153.38 155.08 35.74 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.064 0.459 . . . . 0.84 111.935 -172.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.551 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 14.0 m120 -62.55 -19.44 63.67 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.409 -0.814 . . . . 1.67 110.476 173.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -49.73 -46.62 50.52 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.775 -0.648 . . . . 1.81 111.307 176.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -94.17 2.5 55.94 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.898 -0.592 . . . . 3.19 110.812 -175.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.551 ' HB3' ' HA ' ' A' ' 62' ' ' ASN . 0.2 OUTLIER -85.25 -24.58 27.72 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-O 121.4 0.619 . . . . 2.14 109.527 -176.51 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -77.2 1.38 18.6 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.739 -0.664 . . . . 2.03 110.496 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 87.3 mttt 68.8 11.05 8.22 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.344 -0.844 . . . . 3.31 112.7 175.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.6 mmmm -84.51 89.43 7.43 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.155 -0.618 . . . . 1.99 110.229 -178.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.509 HD12 ' N ' ' A' ' 70' ' ' LEU . 3.3 pp -73.77 -34.25 64.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.033 -0.531 . . . . 2.33 111.082 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.509 ' N ' HD12 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -68.0 -33.88 75.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.336 -0.393 . . . . 1.09 111.036 178.387 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.676 ' O ' ' HG2' ' A' ' 74' ' ' ARG . 27.3 m-20 -74.03 -46.17 45.08 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.169 -0.213 . . . . 2.08 111.153 -178.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.48 ' HG2' ' HA ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -61.07 -34.51 75.01 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.21 -0.596 . . . . 2.93 109.918 176.84 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -64.44 -50.67 66.66 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.275 -0.421 . . . . 1.21 110.163 179.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.676 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 4.4 ptm180 -66.15 -36.25 82.62 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.218 -0.446 . . . . 1.67 110.944 -177.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 92.4 mt -66.94 -53.32 32.97 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.712 0.292 . . . . 1.48 110.659 178.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.633 HG13 HD22 ' A' ' 80' ' ' LEU . 54.9 t -58.18 -44.18 87.19 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 CA-C-N 116.029 -0.532 . . . . 0.82 110.895 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.555 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -62.3 -42.03 99.01 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.637 0.236 . . . . 1.14 111.637 -178.655 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 47.2 m -69.15 -48.91 61.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.923 0.392 . . . . 0.69 111.577 -175.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 39.6 mt -75.49 -50.76 22.85 Favored 'Isoleucine or valine' 0 C--O 1.239 0.549 0 CA-C-O 121.522 0.677 . . . . 0.77 110.663 -177.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.9 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 9.6 mp -76.61 -5.36 47.42 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-N 115.631 -0.713 . . . . 0.78 111.377 -175.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.555 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 18.7 tppt? -52.39 -63.63 1.08 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.559 -0.534 . . . . 1.93 109.559 172.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -75.36 -30.71 60.29 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.758 -0.655 . . . . 2.91 110.963 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.9 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 5.0 tp10 -55.96 -54.36 45.68 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.003 0.43 . . . . 1.66 111.539 178.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.775 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 68.7 mt -50.69 -30.42 13.69 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-N 115.388 -0.824 . . . . 0.58 112.494 -178.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 -54.54 -28.29 44.51 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.629 0.252 . . . . 0.92 111.362 -176.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -92.35 0.81 57.47 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.031 0.443 . . . . 1.02 110.951 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.522 HG21 ' HB2' ' A' ' 90' ' ' PHE . 9.5 mt -121.73 143.21 35.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.121 -0.491 . . . . 0.77 109.847 -177.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 37.3 t60 -77.85 -46.06 22.51 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.699 -0.482 . . . . 1.85 109.699 176.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -153.77 102.74 2.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.07 -0.514 . . . . 0.78 110.982 178.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . 0.522 ' HB2' HG21 ' A' ' 87' ' ' ILE . 83.2 t80 -102.33 131.84 48.69 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.278 -0.419 . . . . 0.63 110.24 175.523 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 31.6 t -122.37 157.53 31.62 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.502 -0.555 . . . . 1.27 109.502 178.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -144.43 139.96 28.69 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.078 0.466 . . . . 0.64 110.958 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 26.5 mmtp -121.22 109.13 14.59 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.66 -0.7 . . . . 2.23 109.143 177.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.49 ' HA ' HG23 ' A' ' 59' ' ' ILE . 7.4 p -98.79 131.04 45.22 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.167 0.508 . . . . 1.38 112.23 -172.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.419 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 1.5 m170 -148.75 175.52 11.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.599 -0.728 . . . . 1.98 110.223 174.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.405 ' HB ' ' HD2' ' A' ' 97' ' ' PRO . 74.9 p -103.25 159.24 29.9 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.293 -0.412 . . . . 0.76 111.229 -175.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . 0.405 ' HD2' ' HB ' ' A' ' 96' ' ' THR . 20.4 Cg_endo -61.81 -26.41 79.44 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.634 2.222 . . . . 0.72 111.667 176.495 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.65 -48.94 75.19 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.417 -0.586 . . . . 2.08 109.417 178.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.554 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 11.4 mm-40 -61.24 -49.61 76.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.671 -0.695 . . . . 2.69 110.597 177.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -59.57 -42.88 93.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.856 -0.611 . . . . 1.46 110.882 -178.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -61.48 -37.69 84.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 1.23 110.842 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.801 ' HA ' ' HE3' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -65.18 -38.35 90.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.412 -0.358 . . . . 2.66 110.998 177.247 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 54.3 mt . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 116.041 -0.527 . . . . 1.31 110.67 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.468 ' O ' HG23 ' A' ' 28' ' ' VAL . 41.1 t . . . . . 0 N--CA 1.452 -0.328 0 N-CA-C 110.032 -0.359 . . . . 1.71 110.032 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 10.3 tp -54.08 -31.15 21.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.045 -0.525 . . . . 1.37 111.244 -178.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -59.38 -52.35 65.99 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.033 -0.53 . . . . 1.75 110.449 177.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -71.92 -29.64 64.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.818 -0.628 . . . . 2.5 111.116 -177.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 24' ' ' CYS . 87.1 t -56.94 -50.21 76.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.838 0.351 . . . . 1.04 110.392 177.397 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.699 HG23 ' HG3' ' A' ' 83' ' ' GLU . 1.7 mp -66.68 -39.85 84.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.972 -0.558 . . . . 0.79 110.546 177.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -59.14 -52.19 66.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.95 -0.568 . . . . 2.2 110.89 -177.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -67.24 -36.55 81.88 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.108 0.48 . . . . 1.67 110.494 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 53.4 tttm -64.46 -52.57 57.32 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.592 -0.731 . . . . 2.03 111.592 -176.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.435 HD12 ' N ' ' A' ' 34' ' ' SER . 4.6 pp -71.51 -28.45 63.91 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.753 -0.379 . . . . 0.57 110.549 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.435 ' N ' HD12 ' A' ' 33' ' ' LEU . 39.4 t -63.74 -45.2 90.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.094 0.473 . . . . 1.29 110.024 177.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.0 m -62.16 -27.41 68.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.789 -0.641 . . . . 0.78 111.926 -178.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -93.35 -54.67 3.59 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.031 0.382 . . . . 0.64 112.031 -177.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 96.5 mt -72.47 -30.83 64.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.373 -0.376 . . . . 0.94 111.335 -175.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm 61.12 68.07 1.31 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.871 -0.604 . . . . 3.36 111.45 -178.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.445 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 72.6 Cg_endo -90.32 126.92 1.36 Allowed 'Trans proline' 0 N--CA 1.447 -1.245 0 C-N-CA 122.549 2.166 . . . . 0.63 111.824 173.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.9 p -64.53 -26.36 68.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.301 0.572 . . . . 0.73 110.191 177.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.541 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 77.9 t80 -141.78 140.22 32.98 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.373 -0.83 . . . . 0.76 109.319 173.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -142.15 108.76 5.35 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.898 -0.778 . . . . 1.55 108.898 179.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.554 ' HB3' ' HB ' ' A' ' 58' ' ' VAL . 27.1 tt0 -100.14 140.36 34.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.402 -0.363 . . . . 2.23 110.104 -178.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -107.45 120.39 42.05 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.09 0.472 . . . . 1.72 110.862 -179.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 40.8 t -109.85 125.56 67.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 108.864 -0.791 . . . . 1.08 108.864 172.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -69.92 113.52 7.22 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.002 0.429 . . . . 1.83 109.908 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.432 ' O ' ' HB2' ' A' ' 54' ' ' SER . 0.7 OUTLIER . . . . . 0 C--N 1.32 -0.677 0 CA-C-N 116.109 -0.496 . . . . 2.76 110.394 -176.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.432 ' HB2' ' O ' ' A' ' 47' ' ' LYS . 14.6 m . . . . . 0 N--CA 1.447 -0.592 0 N-CA-C 109.808 -0.441 . . . . 1.71 109.808 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -135.14 141.37 45.95 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.654 -0.248 . . . . 1.15 110.502 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.68 108.44 17.49 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.455 -0.943 . . . . 1.35 108.455 174.492 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.78 118.54 36.84 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.996 0.427 . . . . 0.51 111.525 -173.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.554 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 32.2 t -83.59 112.5 21.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.538 -0.541 . . . . 0.55 109.538 177.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.507 HG12 ' HA ' ' A' ' 94' ' ' CYS . 2.8 pt -96.87 145.29 9.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.178 0.513 . . . . 1.18 110.675 -177.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.541 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 60.8 t -137.86 97.56 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 N-CA-C 108.028 -1.101 . . . . 0.58 108.028 174.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.445 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 40.8 t -144.61 150.66 37.81 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.04 0.756 . . . . 0.84 113.04 -170.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.689 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 1.0 OUTLIER -67.22 -19.19 65.5 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 114.818 -1.083 . . . . 1.67 110.886 172.939 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -55.55 -32.93 63.38 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.291 0.478 . . . . 1.81 112.291 -172.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -104.35 -3.07 24.62 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.191 0.441 . . . . 3.19 112.191 -173.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.689 ' HG2' ' O ' ' A' ' 62' ' ' ASN . 9.6 pt-20 -76.73 0.4 20.61 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.906 -0.496 . . . . 2.14 111.15 -177.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.445 ' OD2' ' HG3' ' A' ' 68' ' ' LYS . 26.6 t70 -88.98 -8.71 53.59 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.064 0.459 . . . . 2.03 110.061 177.146 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt 77.32 -13.82 0.91 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 115.244 -0.889 . . . . 3.31 112.887 174.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.445 ' HG3' ' OD2' ' A' ' 66' ' ' ASP . 29.9 mtmm -72.28 111.85 7.85 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.961 0.41 . . . . 1.99 110.971 176.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.4 pp -73.87 -31.41 63.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.796 -0.638 . . . . 2.33 111.738 -176.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.429 HD22 ' C ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -65.9 -31.1 71.85 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.677 -0.409 . . . . 1.09 111.335 -175.002 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.545 ' O ' ' HG2' ' A' ' 74' ' ' ARG . 1.5 t70 -73.88 -37.13 64.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.248 0.547 . . . . 2.08 109.969 -178.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.3 tmm_? -63.66 -44.14 94.66 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.967 -0.753 . . . . 2.93 108.967 174.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 21.1 t60 -61.48 -50.25 73.51 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.243 -0.889 . . . . 1.21 111.272 -178.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.545 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 9.3 ptm180 -62.0 -38.6 89.26 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.5 -0.318 . . . . 1.67 111.192 -177.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -67.4 -54.18 22.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.973 0.416 . . . . 1.48 110.633 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.86 HG13 HD22 ' A' ' 80' ' ' LEU . 65.2 t -58.86 -48.67 85.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.062 -0.517 . . . . 0.82 111.237 -177.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.497 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -59.37 -48.23 82.42 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 121.161 -0.216 . . . . 1.14 111.464 -177.176 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 58.7 m -62.45 -54.77 35.23 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.813 0.671 . . . . 0.69 112.813 -173.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.639 HG22 ' OE2' ' A' ' 83' ' ' GLU . 5.1 mp -85.08 -48.38 16.44 Favored 'Isoleucine or valine' 0 C--O 1.247 0.947 0 CA-C-O 121.545 0.688 . . . . 0.77 111.103 -174.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.86 HD22 HG13 ' A' ' 76' ' ' VAL . 8.1 mp -68.51 -10.32 54.85 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.972 -0.558 . . . . 0.78 110.752 -177.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.497 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 20.7 tptm -52.01 -58.44 6.52 Favored 'General case' 0 C--N 1.333 -0.112 0 N-CA-C 109.493 -0.558 . . . . 1.93 109.493 165.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.572 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 39.5 mt-10 -60.8 -36.43 79.02 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.331 -0.85 . . . . 2.91 110.72 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.699 ' HG3' HG23 ' A' ' 29' ' ' ILE . 0.0 OUTLIER -52.76 -55.6 21.69 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 122.178 0.99 . . . . 1.66 110.381 173.254 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.757 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 54.6 mt -50.25 -30.6 12.09 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 113.061 -1.881 . . . . 0.58 112.691 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.572 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 20.7 mm-40 -61.64 -25.6 67.47 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 120.909 0.385 . . . . 0.92 110.736 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -98.35 -29.85 12.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.003 -0.544 . . . . 1.02 111.133 -176.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.488 HD12 ' HB2' ' A' ' 90' ' ' PHE . 2.7 mt -94.95 170.86 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 109.649 -0.5 . . . . 0.77 109.649 -178.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -94.63 -59.34 1.95 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.199 -0.667 . . . . 1.85 109.199 169.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -133.71 111.27 10.43 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.765 -0.652 . . . . 0.78 110.312 178.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . 0.488 ' HB2' HD12 ' A' ' 87' ' ' ILE . 90.2 t80 -95.21 122.51 37.97 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.112 0.482 . . . . 0.63 110.278 177.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 41.6 t -111.07 151.71 27.75 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.721 -0.672 . . . . 1.27 109.381 178.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -140.27 145.29 37.11 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.913 0.387 . . . . 0.64 110.849 -177.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.5 ' HG3' HG22 ' A' ' 58' ' ' VAL . 61.9 mmtt -105.89 113.87 27.68 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.325 -0.991 . . . . 2.23 108.325 173.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.507 ' HA ' HG12 ' A' ' 59' ' ' ILE . 5.5 p -83.39 110.35 18.08 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.093 0.473 . . . . 1.38 111.087 -176.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -135.86 160.29 39.04 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.433 0.635 . . . . 1.98 111.254 178.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.4 p -120.23 156.45 54.99 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.398 -0.819 . . . . 0.76 110.724 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -56.52 -52.12 7.71 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 123.259 2.639 . . . . 0.72 114.393 -170.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -61.19 -47.37 86.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.79 0.328 . . . . 2.08 111.398 -173.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 53.6 mp0 -68.14 -42.67 79.76 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.163 -0.471 . . . . 2.69 111.105 -178.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -63.95 -33.42 75.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 1.46 111.498 -176.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -62.8 -33.14 74.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.96 0.41 . . . . 1.23 111.147 -178.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.668 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -75.17 -20.63 59.24 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.438 -0.346 . . . . 2.66 110.684 179.478 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 83.5 mt . . . . . 0 C--N 1.326 -0.443 0 N-CA-C 109.84 -0.43 . . . . 1.31 109.84 175.819 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.447 ' O ' HG23 ' A' ' 28' ' ' VAL . 43.0 t . . . . . 0 N--CA 1.451 -0.414 0 N-CA-C 108.916 -0.772 . . . . 1.71 108.916 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.408 ' O ' HD13 ' A' ' 29' ' ' ILE . 7.2 tp -55.85 -43.93 76.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 120.624 0.249 . . . . 1.37 110.872 178.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -66.06 -35.68 81.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.97 0.414 . . . . 1.75 110.412 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -61.8 -39.32 91.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.819 -0.628 . . . . 2.5 110.432 179.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 24' ' ' CYS . 65.3 t -60.82 -49.5 84.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.91 -0.586 . . . . 1.04 110.254 178.164 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.442 HG13 ' CD ' ' A' ' 83' ' ' GLU . 1.7 mp -57.4 -49.75 79.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 116.089 -0.505 . . . . 0.79 110.62 178.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 81.9 mt-10 -58.77 -51.97 67.69 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.231 -0.441 . . . . 2.2 112.099 -176.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -70.16 -34.1 72.58 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.804 0.335 . . . . 1.67 110.815 -174.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.404 ' HD2' ' OE2' ' A' ' 83' ' ' GLU . 37.6 ttmt -61.82 -48.86 78.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.269 -0.423 . . . . 2.03 110.934 -178.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.6 pp -73.51 -26.22 60.79 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.887 -0.325 . . . . 0.57 110.629 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.432 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 67.0 m -72.37 -34.56 68.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.508 -0.314 . . . . 1.29 110.628 178.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.2 m -67.16 -27.43 67.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.15 0.5 . . . . 0.78 111.021 176.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.34 -54.82 3.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.095 -0.502 . . . . 0.64 111.843 -176.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.427 HD11 HG22 ' A' ' 76' ' ' VAL . 80.1 mt -84.06 -29.71 26.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.469 -0.332 . . . . 0.94 111.023 -175.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.3 tptm 55.84 78.38 0.38 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 115.454 -0.794 . . . . 3.36 111.216 -176.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.495 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 83.6 Cg_endo -87.97 173.56 4.95 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 122.67 2.247 . . . . 0.63 112.45 178.349 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.9 p -106.66 -27.61 10.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.141 0.496 . . . . 0.73 110.287 175.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.51 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 86.2 t80 -136.63 138.57 41.3 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.825 -0.625 . . . . 0.76 109.886 177.067 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 41.5 tp -142.21 116.45 9.5 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.255 -0.43 . . . . 1.55 110.418 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -125.58 109.53 12.76 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.4 -0.364 . . . . 2.23 110.674 178.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.671 ' HG ' ' HB2' ' A' ' 57' ' ' ALA . 9.1 mp -94.87 123.58 38.42 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.394 -0.595 . . . . 1.72 109.394 173.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 86.1 t -103.33 133.2 47.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 115.974 -0.557 . . . . 1.08 110.489 -176.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -64.11 110.08 2.05 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.711 -0.677 . . . . 1.83 109.595 174.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.915 ' HD2' ' HB2' ' A' ' 56' ' ' ASP . 79.3 tttt . . . . . 0 C--N 1.322 -0.611 0 CA-C-N 115.105 -0.952 . . . . 2.76 109.706 -173.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.504 ' HB3' ' HB3' ' A' ' 89' ' ' ALA . 1.7 p . . . . . 0 N--CA 1.454 -0.237 0 CA-C-O 120.478 0.18 . . . . 1.71 110.696 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -134.53 144.38 47.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.939 0.399 . . . . 1.15 111.372 -177.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.915 ' HB2' ' HD2' ' A' ' 47' ' ' LYS . 5.5 t70 -115.88 114.15 24.3 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.386 -0.968 . . . . 1.35 108.386 174.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.671 ' HB2' ' HG ' ' A' ' 44' ' ' LEU . . . -110.63 126.54 54.59 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.436 0.532 . . . . 0.51 112.436 -171.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.4 t -93.08 119.84 41.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.601 -0.727 . . . . 0.55 109.67 175.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.465 HD11 ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER -109.87 122.24 64.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 121.244 0.545 . . . . 1.18 110.471 -178.56 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.51 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 89.8 t -114.45 107.82 23.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.596 -0.729 . . . . 0.58 109.92 178.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.495 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 30.5 t -151.02 154.93 37.98 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.948 0.404 . . . . 0.84 111.693 -174.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.5 ' ND2' ' HG2' ' A' ' 97' ' ' PRO . 1.0 OUTLIER -67.25 -18.86 65.4 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.744 -0.662 . . . . 1.67 110.569 173.992 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -53.31 -24.19 11.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.258 -0.428 . . . . 1.81 111.892 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -103.23 -8.31 20.49 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 111.994 0.368 . . . . 3.19 111.994 -177.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.413 ' HB3' HG21 ' A' ' 96' ' ' THR . 0.0 OUTLIER -72.91 -14.31 61.44 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.96 -0.463 . . . . 2.14 110.988 -174.693 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -78.36 0.57 25.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.104 -0.498 . . . . 2.03 110.545 -176.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 84.9 tttt 71.73 2.09 4.15 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.705 -0.679 . . . . 3.31 111.174 176.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -80.28 89.62 5.51 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.046 0.45 . . . . 1.99 110.272 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.8 tt -70.91 -49.03 50.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.857 -0.611 . . . . 2.33 109.732 -179.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.515 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -60.85 -33.25 72.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.85 -0.613 . . . . 1.09 111.628 -179.557 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.515 ' N ' HD22 ' A' ' 70' ' ' LEU . 35.8 t70 -74.07 -48.06 32.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.931 0.396 . . . . 2.08 110.293 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.15 -36.28 74.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.243 0.544 . . . . 2.93 109.636 176.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 48.8 t60 -64.21 -54.8 27.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.505 -0.77 . . . . 1.21 110.774 178.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.438 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 15.5 ptm180 -64.98 -40.39 94.91 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.004 0.372 . . . . 1.67 112.004 -175.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 60.2 mt -60.22 -53.34 58.91 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.922 0.392 . . . . 1.48 110.787 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.427 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 78.6 t -61.17 -43.59 96.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.922 -0.581 . . . . 0.82 110.626 179.589 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.502 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -64.17 -35.88 82.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.279 -0.418 . . . . 1.14 112.078 -177.365 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 88.6 m -71.92 -44.39 63.72 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.775 0.322 . . . . 0.69 111.335 -176.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.1 mt -76.84 -50.86 20.21 Favored 'Isoleucine or valine' 0 C--O 1.244 0.811 0 CA-C-O 121.769 0.795 . . . . 0.77 110.612 -178.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.775 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 10.5 mp -74.14 -9.29 58.47 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.356 -0.838 . . . . 0.78 111.418 -176.38 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 16.2 tttm -53.88 -61.93 1.98 Allowed 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 109.778 -0.453 . . . . 1.93 109.778 172.071 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.409 ' HA ' HE21 ' A' ' 85' ' ' GLN . 0.4 OUTLIER -72.18 -30.07 64.61 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.689 -0.687 . . . . 2.91 110.288 -178.074 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.681 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.5 tp10 -55.88 -47.52 77.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.334 -0.848 . . . . 1.66 111.588 175.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.775 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 54.4 mt -49.96 -30.87 11.23 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 114.8 -1.091 . . . . 0.58 113.58 -178.259 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.409 HE21 ' HA ' ' A' ' 82' ' ' GLU . 2.4 mp0 -55.54 -18.06 6.63 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.562 0.578 . . . . 0.92 112.562 -179.253 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -87.08 -8.19 57.31 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.749 0.309 . . . . 1.02 111.228 179.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.488 HD12 ' HB2' ' A' ' 90' ' ' PHE . 0.4 OUTLIER -133.27 175.87 10.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.885 -0.413 . . . . 0.77 109.885 -177.588 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 14.4 p80 -116.28 -13.99 11.07 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.622 -0.431 . . . . 1.85 110.969 173.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.504 ' HB3' ' HB3' ' A' ' 54' ' ' SER . . . -162.15 105.94 1.18 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.919 0.39 . . . . 0.78 111.418 -178.447 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . 0.488 ' HB2' HD12 ' A' ' 87' ' ' ILE . 91.2 t80 -132.17 122.04 24.66 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.919 -0.582 . . . . 0.63 110.046 175.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.4 p -116.54 144.8 43.9 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.712 0.291 . . . . 1.27 110.721 179.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -123.38 145.95 48.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.945 0.402 . . . . 0.64 111.102 -178.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 26.4 mmtp -125.66 120.23 30.17 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.877 -0.786 . . . . 2.23 108.877 177.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.407 ' HA ' HG23 ' A' ' 59' ' ' ILE . 5.9 p -101.25 135.47 42.67 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.487 0.551 . . . . 1.38 112.487 -172.32 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 8.5 m80 -147.74 172.61 13.82 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.536 -0.756 . . . . 1.98 109.473 174.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.413 HG21 ' HB3' ' A' ' 65' ' ' GLU . 0.3 OUTLIER -111.04 158.67 35.19 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-O 121.014 0.435 . . . . 0.76 111.843 -177.925 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . 0.5 ' HG2' ' ND2' ' A' ' 62' ' ' ASN . 26.1 Cg_exo -62.25 -18.36 61.99 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.201 2.601 . . . . 0.72 112.353 -177.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -59.63 -51.23 70.69 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.895 -0.593 . . . . 2.08 109.989 174.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -60.97 -44.81 96.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.109 0.481 . . . . 2.69 110.153 175.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.487 ' HB3' ' HA ' ' A' ' 97' ' ' PRO . 74.1 t80 -57.6 -41.24 80.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.367 -0.833 . . . . 1.46 111.486 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -58.87 -39.47 81.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.421 -0.354 . . . . 1.23 111.646 -178.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.694 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.8 OUTLIER -65.4 -37.68 87.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.817 0.341 . . . . 2.66 110.222 179.363 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 69.8 mt . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 115.703 -0.68 . . . . 1.31 111.114 -179.025 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 51.8 t . . . . . 0 N--CA 1.452 -0.355 0 N-CA-C 109.512 -0.551 . . . . 1.71 109.512 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.517 HD11 ' HB3' ' A' ' 86' ' ' ASN . 9.6 tp -61.41 -32.88 54.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.832 0.349 . . . . 1.37 110.899 -179.097 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -63.67 -38.9 92.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.266 -0.425 . . . . 1.75 110.186 178.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -67.16 -34.11 76.86 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.981 -0.554 . . . . 2.5 110.694 177.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 71.3 t -59.0 -55.35 24.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.716 0.293 . . . . 1.04 110.619 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.478 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 2.0 mp -63.91 -44.63 98.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.982 -0.554 . . . . 0.79 110.455 178.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.456 ' O ' ' HB2' ' A' ' 34' ' ' SER . 21.0 tt0 -52.4 -51.12 60.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.849 -0.614 . . . . 2.2 110.904 179.332 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -71.81 -38.07 70.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.446 -0.797 . . . . 1.67 111.344 -173.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -60.19 -55.96 27.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.322 -0.399 . . . . 2.03 111.583 -176.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 3.7 pp -74.1 -25.32 59.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.671 -0.241 . . . . 0.57 111.508 -178.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.456 ' HB2' ' O ' ' A' ' 30' ' ' GLU . 8.0 t -68.65 -36.76 79.0 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 121.044 -0.262 . . . . 1.29 110.652 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.1 m -70.43 -27.49 64.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.762 0.315 . . . . 0.78 110.946 178.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.429 ' CB ' HG12 ' A' ' 79' ' ' ILE . . . -85.25 -54.88 4.33 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.067 0.395 . . . . 0.64 112.067 -176.061 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.5 mt -85.09 -34.84 22.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.647 0.26 . . . . 0.94 110.839 -176.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.5 ttmt 58.92 84.78 0.2 Allowed Pre-proline 0 C--O 1.234 0.26 0 CA-C-N 115.391 -0.822 . . . . 3.36 111.727 178.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.755 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 93.8 Cg_endo -93.77 161.27 2.28 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 123.073 2.516 . . . . 0.63 112.72 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 32.7 p -89.4 -21.1 23.22 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.695 0.76 . . . . 0.73 109.177 173.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.625 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 89.9 t80 -141.39 132.07 25.63 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.053 -0.976 . . . . 0.76 109.47 175.079 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.5 tp -140.67 127.69 20.74 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.268 -0.423 . . . . 1.55 110.249 -179.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -139.14 124.11 18.82 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.959 0.409 . . . . 2.23 110.609 177.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.8 mp -95.84 117.27 30.25 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.934 -0.575 . . . . 1.72 109.509 175.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 31.6 t -103.12 130.64 52.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.684 -0.689 . . . . 1.08 110.262 -176.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -79.34 101.42 8.08 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.819 -0.437 . . . . 1.83 109.819 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.412 ' HG3' ' HB2' ' A' ' 56' ' ' ASP . 11.4 mmmm . . . . . 0 C--N 1.325 -0.471 0 CA-C-O 121.316 0.579 . . . . 2.76 110.354 -175.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 N--CA 1.455 -0.208 0 N-CA-C 109.834 -0.432 . . . . 1.71 109.834 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -121.64 161.56 22.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.995 0.426 . . . . 1.15 111.312 -174.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.425 ' HA ' ' O ' ' A' ' 91' ' ' SER . 12.7 t70 -118.15 127.23 53.57 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.252 -1.018 . . . . 1.35 108.252 171.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.91 115.8 30.85 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.138 0.494 . . . . 0.51 111.602 -174.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.3 t -81.76 111.15 17.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.652 -0.704 . . . . 0.55 109.194 174.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.479 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -106.56 114.34 45.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.188 0.518 . . . . 1.18 110.049 -178.494 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.625 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 97.1 t -110.02 103.86 16.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.814 -0.63 . . . . 0.58 109.976 178.054 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.755 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 46.2 t -154.55 149.38 26.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.152 0.501 . . . . 0.84 111.171 -177.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.563 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 40.8 m-80 -67.3 -18.64 65.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.451 -0.795 . . . . 1.67 111.176 176.035 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -47.97 -24.45 1.06 Allowed 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 112.369 0.507 . . . . 1.81 112.369 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.51 ' HD1' ' HB2' ' A' ' 68' ' ' LYS . 76.9 m-85 -118.6 16.05 13.68 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 112.196 0.443 . . . . 3.19 112.196 -178.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.563 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 1.0 OUTLIER -68.82 -15.85 63.62 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 120.795 0.331 . . . . 2.14 111.734 -176.153 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.593 ' HB3' ' HD3' ' A' ' 68' ' ' LYS . 31.0 t70 -84.37 15.6 3.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.252 0.548 . . . . 2.03 110.118 179.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.415 ' NZ ' ' HB2' ' A' ' 67' ' ' LYS . 10.6 mtmp? 57.62 51.02 10.03 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.616 -0.72 . . . . 3.31 109.845 -175.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.914 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 31.2 mmmt -76.91 89.03 3.48 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.871 -0.604 . . . . 1.99 110.436 -176.149 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.7 tt -73.66 -55.01 6.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.294 0.568 . . . . 2.33 109.681 177.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.493 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.5 -31.43 71.56 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.418 -0.81 . . . . 1.09 110.796 -178.341 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.914 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 25.5 t70 -73.68 -35.71 65.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.901 0.382 . . . . 2.08 110.306 -178.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -39.4 93.55 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.317 -0.623 . . . . 2.93 109.317 174.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 39.6 t60 -65.51 -51.35 60.6 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.895 -0.593 . . . . 1.21 110.64 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.544 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 3.8 ptm180 -66.54 -48.19 70.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.311 -0.404 . . . . 1.67 111.81 -176.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -61.39 -45.03 96.06 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.57 0.224 . . . . 1.48 111.446 -177.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.755 HG13 HD22 ' A' ' 80' ' ' LEU . 41.9 t -59.99 -42.57 90.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.427 -0.351 . . . . 0.82 110.732 178.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.62 -43.6 89.06 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.947 -0.301 . . . . 1.14 111.181 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 45.1 m -61.82 -55.92 24.93 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.988 0.366 . . . . 0.69 111.988 -177.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.429 HG12 ' CB ' ' A' ' 36' ' ' ALA . 4.2 mp -78.5 -48.6 22.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 120.819 0.342 . . . . 0.77 111.416 -176.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.774 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.7 mp -73.48 -6.68 47.92 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 116.509 -0.314 . . . . 0.78 111.741 -173.616 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -49.75 -54.59 18.09 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.335 -0.617 . . . . 1.93 109.335 167.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.428 ' O ' ' HG2' ' A' ' 85' ' ' GLN . 36.6 tt0 -75.19 -40.27 59.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.467 -0.788 . . . . 2.91 110.713 178.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.774 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.8 tp10 -53.71 -51.34 63.58 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.456 -0.793 . . . . 1.66 112.025 -177.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.687 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 67.3 mt -50.31 -30.71 12.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.204 -0.907 . . . . 0.58 112.614 -177.089 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.428 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 17.6 mm-40 -52.24 -26.53 12.03 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 111.886 0.328 . . . . 0.92 111.886 -176.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.517 ' HB3' HD11 ' A' ' 25' ' ' ILE . 29.8 m-80 -100.23 1.49 41.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.872 0.367 . . . . 1.02 111.209 -177.231 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.456 HD11 ' HG3' ' A' ' 83' ' ' GLU . 0.5 OUTLIER -130.56 175.9 9.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 110.007 -0.368 . . . . 0.77 110.007 -175.552 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 56.1 m-70 -123.16 -73.85 0.63 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.314 0.578 . . . . 1.85 110.008 176.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -104.91 57.72 0.69 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.406 -0.816 . . . . 0.78 110.505 -175.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -75.19 145.27 42.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.984 -0.553 . . . . 0.63 110.887 -177.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.425 ' O ' ' HA ' ' A' ' 56' ' ' ASP . 40.1 t -140.32 167.62 21.72 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.927 -0.579 . . . . 1.27 109.513 178.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -148.58 149.88 32.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.713 0.292 . . . . 0.64 110.707 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -125.03 109.85 13.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.183 -0.462 . . . . 2.23 110.044 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.423 ' HA ' HG23 ' A' ' 59' ' ' ILE . 4.1 p -83.41 126.91 33.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.23 0.538 . . . . 1.38 111.713 -176.287 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.452 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 45.9 m80 -142.07 162.94 34.22 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.556 -0.747 . . . . 1.98 110.038 178.274 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.5 p -112.56 154.61 44.6 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 116.524 -0.307 . . . . 0.76 110.963 176.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . 0.497 ' HG2' ' ND2' ' A' ' 62' ' ' ASN . 35.8 Cg_exo -59.1 -26.69 82.62 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 123.031 2.487 . . . . 0.72 112.522 -178.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -61.2 -46.43 90.48 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.872 -0.604 . . . . 2.08 110.173 177.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -71.57 -41.07 69.49 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.802 -0.635 . . . . 2.69 110.706 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -56.73 -40.94 76.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.906 -0.588 . . . . 1.46 111.614 -178.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -58.1 -35.89 72.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.85 0.357 . . . . 1.23 111.043 -178.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.692 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -74.18 -32.58 63.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.802 0.334 . . . . 2.66 110.288 179.04 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 85.8 mt . . . . . 0 C--N 1.325 -0.467 0 CA-C-N 116.323 -0.399 . . . . 1.31 110.54 179.173 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.4 t . . . . . 0 C--O 1.235 0.293 0 N-CA-C 109.47 -0.567 . . . . 1.71 109.47 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.505 HD11 ' HB3' ' A' ' 86' ' ' ASN . 8.6 tp -56.87 -35.82 47.92 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-O 120.886 0.374 . . . . 1.37 110.291 176.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -58.4 -45.98 87.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.832 -0.622 . . . . 1.75 110.527 176.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.817 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -57.66 -42.85 84.33 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.85 -0.614 . . . . 2.5 110.627 -178.869 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.526 ' O ' ' HG2' ' A' ' 32' ' ' LYS . 60.4 t -58.82 -49.98 81.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-N 116.023 -0.535 . . . . 1.04 110.711 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.551 HD11 ' HB2' ' A' ' 86' ' ' ASN . 1.7 mp -58.8 -46.01 91.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.895 -0.593 . . . . 0.79 110.243 178.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 62.2 mt-10 -53.33 -50.42 65.03 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.106 -0.497 . . . . 2.2 111.037 177.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -60.03 -33.88 72.62 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.227 -0.442 . . . . 1.67 111.853 -176.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.526 ' HG2' ' O ' ' A' ' 28' ' ' VAL . 14.8 mmmm -71.27 -55.65 7.63 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.858 -0.337 . . . . 2.03 111.091 -178.105 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.496 HD12 ' N ' ' A' ' 34' ' ' SER . 4.1 pp -69.43 -28.55 66.23 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.9 0.333 . . . . 0.57 111.9 -176.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.496 ' N ' HD12 ' A' ' 33' ' ' LEU . 52.5 p -72.1 -33.29 67.74 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.876 -0.33 . . . . 1.29 110.884 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 52.3 m -68.14 -34.84 77.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.916 0.388 . . . . 0.78 110.755 178.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.28 -54.56 4.24 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.243 0.46 . . . . 0.64 112.243 -175.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.3 mt -81.6 -23.85 36.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.396 -0.365 . . . . 0.94 110.805 -175.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.401 ' HA ' ' O ' ' A' ' 34' ' ' SER . 64.3 mttp 49.28 69.19 2.84 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 115.579 -0.737 . . . . 3.36 112.193 -179.473 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.508 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 71.5 Cg_endo -80.85 134.53 9.62 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.039 1.826 . . . . 0.63 112.034 176.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 20.8 p -67.02 -30.72 70.88 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.091 0.472 . . . . 0.73 110.045 177.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.585 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 81.3 t80 -140.43 139.16 35.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.811 -0.632 . . . . 0.76 109.851 176.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 60.9 tp -135.1 121.69 20.69 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.339 -0.391 . . . . 1.55 110.131 178.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.404 ' HB3' ' HB ' ' A' ' 58' ' ' VAL . 43.3 tt0 -119.49 115.74 24.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.982 0.42 . . . . 2.23 110.517 179.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -91.26 115.64 28.19 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.06 -0.518 . . . . 1.72 109.735 178.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 40.4 t -114.41 142.44 27.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.498 0.666 . . . . 1.08 110.676 -178.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.56 123.92 23.53 Favored 'General case' 0 N--CA 1.438 -1.041 0 CA-C-N 114.957 -1.019 . . . . 1.83 108.836 178.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.404 ' HD3' ' HB2' ' A' ' 54' ' ' SER . 45.4 tttp . . . . . 0 C--N 1.325 -0.488 0 CA-C-N 115.929 -0.578 . . . . 2.76 111.335 -169.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.509 ' HB3' ' HB3' ' A' ' 89' ' ' ALA . 4.2 p . . . . . 0 N--CA 1.446 -0.653 0 CA-C-O 120.95 0.405 . . . . 1.71 110.571 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -113.12 132.53 55.41 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.115 -0.493 . . . . 1.15 110.03 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -114.82 109.5 18.26 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.342 -0.984 . . . . 1.35 108.342 175.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.99 120.06 40.79 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.256 0.55 . . . . 0.51 111.832 -170.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.404 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 59.0 t -79.26 114.21 19.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 115.35 -0.841 . . . . 0.55 109.016 173.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.487 ' CG1' ' HA ' ' A' ' 94' ' ' CYS . 1.2 pp -96.73 136.19 28.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.719 -0.475 . . . . 1.18 109.719 -177.498 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.585 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 90.0 t -130.81 97.9 3.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 108.772 -0.825 . . . . 0.58 108.772 176.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.508 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 40.8 t -145.39 150.92 37.43 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.291 0.567 . . . . 0.84 111.977 -173.151 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.691 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 15.7 m120 -67.96 -19.15 64.93 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.354 -0.839 . . . . 1.67 110.178 172.029 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -62.57 -9.07 7.6 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.013 0.435 . . . . 1.81 111.325 -178.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -116.34 -11.83 11.18 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.125 0.417 . . . . 3.19 112.125 -177.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.691 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -74.01 -13.73 60.91 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.382 0.512 . . . . 2.14 112.382 -171.473 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.444 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . 7.7 t70 -91.55 10.95 25.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.006 0.431 . . . . 2.03 110.059 178.268 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.49 ' HE3' ' HB2' ' A' ' 67' ' ' LYS . 24.9 ttmt 65.97 39.05 4.66 Favored 'General case' 0 C--N 1.338 0.105 0 CA-C-N 115.627 -0.715 . . . . 3.31 109.392 176.473 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.642 ' HB3' ' HB2' ' A' ' 71' ' ' ASP . 64.4 mmtt -78.93 101.29 7.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.2 -0.909 . . . . 1.99 112.469 -173.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 28.9 tp -73.81 -59.74 2.58 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.026 -0.534 . . . . 2.33 110.146 171.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.431 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.82 -34.12 76.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.756 -0.657 . . . . 1.09 111.821 -170.895 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.642 ' HB2' ' HB3' ' A' ' 68' ' ' LYS . 27.1 m-20 -73.86 -43.55 58.27 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.699 0.259 . . . . 2.08 111.699 -176.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 34.9 ptt180 -64.6 -35.37 80.78 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.079 -0.648 . . . . 2.93 109.586 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -65.13 -52.99 51.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.874 -0.603 . . . . 1.21 110.498 179.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.505 ' CD ' ' HA ' ' A' ' 71' ' ' ASP . 5.8 ptm180 -64.6 -43.46 93.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.254 -0.43 . . . . 1.67 111.296 -175.392 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.421 HD12 ' HG3' ' A' ' 74' ' ' ARG . 8.4 mp -65.56 -48.47 72.3 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.552 0.215 . . . . 1.48 110.961 -178.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.765 HG13 HD22 ' A' ' 80' ' ' LEU . 38.2 t -59.86 -43.88 93.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.554 -0.294 . . . . 0.82 110.866 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -62.76 -46.83 86.22 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.868 -0.333 . . . . 1.14 111.04 -178.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 63.0 m -61.42 -55.94 25.77 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.17 0.433 . . . . 0.69 112.17 -177.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.0 mp -75.29 -50.25 24.94 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 120.968 0.413 . . . . 0.77 111.208 -175.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.972 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.5 mp -71.74 -5.5 34.47 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 116.371 -0.377 . . . . 0.78 111.279 -177.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -49.92 -63.97 0.95 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.065 0.46 . . . . 1.93 109.834 170.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.428 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 5.4 pt-20 -75.39 -31.43 60.45 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.156 -0.474 . . . . 2.91 110.929 177.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.972 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 34.0 tt0 -58.48 -43.96 89.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.543 -0.299 . . . . 1.66 111.127 -177.222 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.76 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 69.3 mt -57.54 -30.6 65.33 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.127 -0.488 . . . . 0.58 111.671 179.435 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.428 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 24.4 mm-40 -59.54 -17.93 36.39 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.848 0.356 . . . . 0.92 111.121 -177.202 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.551 ' HB2' HD11 ' A' ' 29' ' ' ILE . 23.4 m-80 -102.44 3.05 37.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.428 -0.351 . . . . 1.02 110.957 -177.007 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.497 HG21 ' HB2' ' A' ' 90' ' ' PHE . 8.9 mt -124.12 147.67 28.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.645 0.259 . . . . 0.77 110.564 -175.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 59.0 t60 -78.97 -45.18 20.88 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.811 -0.44 . . . . 1.85 109.811 175.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.509 ' HB3' ' HB3' ' A' ' 54' ' ' SER . . . -158.92 106.16 1.81 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 0.78 110.504 178.446 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . 0.497 ' HB2' HG21 ' A' ' 87' ' ' ILE . 76.2 t80 -103.35 138.02 40.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.259 -0.428 . . . . 0.63 110.357 177.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 50.7 m -140.26 145.14 36.94 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.668 -0.493 . . . . 1.27 109.668 175.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -123.35 151.79 42.16 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.168 0.508 . . . . 0.64 111.637 -175.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.0 mmtm -117.38 118.28 31.8 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.437 -0.801 . . . . 2.23 108.957 173.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.487 ' HA ' ' CG1' ' A' ' 59' ' ' ILE . 80.8 m -83.78 117.23 23.13 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.137 0.494 . . . . 1.38 111.605 -171.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 70.2 m80 -140.33 161.22 38.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.958 -0.565 . . . . 1.98 110.332 176.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.653 ' HB ' ' HD2' ' A' ' 97' ' ' PRO . 31.0 p -110.63 168.25 7.88 Favored Pre-proline 0 C--N 1.32 -0.676 0 N-CA-C 109.209 -0.664 . . . . 0.76 109.209 174.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . 0.653 ' HD2' ' HB ' ' A' ' 96' ' ' THR . 12.1 Cg_endo -58.29 -28.53 84.88 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.092 1.861 . . . . 0.72 111.456 174.128 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.404 ' H ' HD22 ' A' ' 98' ' ' LEU . 2.6 mm? -72.92 -51.44 18.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 2.08 109.883 178.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.578 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 1.5 mp0 -58.54 -50.99 71.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.008 -0.542 . . . . 2.69 111.133 179.357 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -65.21 -43.39 91.71 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.742 0.275 . . . . 1.46 111.742 -175.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -62.99 -33.31 75.14 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.988 0.423 . . . . 1.23 110.769 -177.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.606 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.3 OUTLIER -78.41 -15.53 58.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.486 -0.325 . . . . 2.66 111.173 179.024 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 93.6 mt . . . . . 0 N--CA 1.464 0.226 0 CA-C-O 121.087 0.47 . . . . 1.31 109.947 175.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.8 m . . . . . 0 N--CA 1.447 -0.585 0 N-CA-C 110.004 -0.369 . . . . 1.71 110.004 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.492 ' O ' HD13 ' A' ' 29' ' ' ILE . 0.0 OUTLIER -57.18 -35.51 48.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.233 -0.439 . . . . 1.37 110.049 179.672 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.86 HE22 ' HG ' ' A' ' 44' ' ' LEU . 53.6 tp60 -57.35 -53.78 54.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.9 -0.591 . . . . 1.75 110.924 177.341 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.9 tptp -63.88 -40.78 97.32 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.894 -0.594 . . . . 2.5 111.04 -173.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 66.6 t -60.55 -46.94 94.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.208 -0.451 . . . . 1.04 111.041 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.538 ' HA ' ' OE2' ' A' ' 83' ' ' GLU . 1.5 mp -58.84 -47.08 90.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.932 -0.576 . . . . 0.79 110.398 179.036 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.526 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 74.8 mt-10 -56.03 -52.0 65.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 2.2 111.003 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -63.34 -36.82 84.96 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.833 0.679 . . . . 1.67 112.833 -172.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -72.57 -47.87 44.58 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.53 -0.468 . . . . 2.03 111.61 -177.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.481 HD12 ' N ' ' A' ' 34' ' ' SER . 4.6 pp -74.26 -31.41 62.55 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 120.581 -0.448 . . . . 0.57 111.722 -179.197 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.481 ' N ' HD12 ' A' ' 33' ' ' LEU . 66.4 m -68.69 -33.58 74.21 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 121.151 -0.22 . . . . 1.29 111.4 -178.195 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.5 m -67.85 -27.33 66.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.95 0.405 . . . . 0.78 110.812 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.95 -52.74 4.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 0.64 111.767 -177.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 73.2 mt -85.0 -33.06 22.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.532 -0.304 . . . . 0.94 111.738 -173.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm 55.48 75.2 0.62 Allowed Pre-proline 0 N--CA 1.466 0.364 0 CA-C-N 116.045 -0.525 . . . . 3.36 112.173 -178.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.526 ' HB3' HG12 ' A' ' 59' ' ' ILE . 72.4 Cg_endo -82.7 133.77 7.13 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.408 2.072 . . . . 0.63 111.989 175.498 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 37.7 p -73.09 -30.53 63.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.578 0.704 . . . . 0.73 109.753 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -141.88 132.55 25.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.111 -0.95 . . . . 0.76 109.328 176.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.43 HD12 ' HG3' ' A' ' 39' ' ' PRO . 1.1 tt -142.24 118.95 11.08 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.196 -0.668 . . . . 1.55 109.196 179.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -116.96 120.51 38.63 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.89 0.376 . . . . 2.23 110.348 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.86 ' HG ' HE22 ' A' ' 26' ' ' GLN . 4.3 mm? -87.86 121.24 30.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.853 -0.612 . . . . 1.72 110.212 178.154 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 40.9 t -109.35 122.11 63.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.215 -0.448 . . . . 1.08 110.339 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -67.92 102.52 1.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.4 -0.593 . . . . 1.83 109.4 176.312 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.519 ' HD2' ' HB2' ' A' ' 56' ' ' ASP . 51.8 tttm . . . . . 0 C--N 1.321 -0.643 0 N-CA-C 109.362 -0.606 . . . . 2.76 109.362 -178.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.9 m . . . . . 0 N--CA 1.455 -0.183 0 CA-C-O 120.834 0.35 . . . . 1.71 110.987 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -125.28 136.17 53.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.945 -0.57 . . . . 1.15 109.6 173.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.519 ' HB2' ' HD2' ' A' ' 47' ' ' LYS . 19.3 t70 -113.24 122.39 47.31 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.89 -0.411 . . . . 1.35 109.89 -177.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -118.77 122.27 42.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.773 0.321 . . . . 0.51 111.606 -175.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 58.3 t -86.86 111.23 21.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 109.552 -0.536 . . . . 0.55 109.552 176.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.526 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -110.01 116.31 51.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.485 0.659 . . . . 1.18 110.627 -176.521 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.653 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 41.8 t -108.09 114.06 45.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.356 -0.838 . . . . 0.58 109.382 176.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 87.5 p -145.66 146.38 31.28 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.245 -0.582 . . . . 0.84 112.256 -177.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -67.22 -22.8 65.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.462 -0.79 . . . . 1.67 110.755 172.251 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -62.59 -32.11 73.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.094 -0.503 . . . . 1.81 112.282 -172.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 31.6 m-85 -98.41 0.51 45.48 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.959 -0.297 . . . . 3.19 111.256 -178.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.08 -18.97 62.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.556 -0.293 . . . . 2.14 111.742 -173.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -84.46 -9.66 58.18 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.918 0.389 . . . . 2.03 110.862 -175.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt 69.12 19.57 7.94 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.884 0.698 . . . . 3.31 112.884 169.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.662 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 29.0 mmmt -75.07 110.76 9.65 Favored 'General case' 0 C--N 1.327 -0.41 0 O-C-N 121.771 -0.581 . . . . 1.99 109.627 178.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.498 ' HA ' ' NE ' ' A' ' 72' ' ' ARG . 3.4 pp -66.53 -48.11 70.76 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.319 0.489 . . . . 2.33 112.319 -167.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.426 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.82 -30.93 70.46 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.877 0.37 . . . . 1.09 110.767 -178.204 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.426 ' N ' HD22 ' A' ' 70' ' ' LEU . 20.4 t70 -73.32 -47.54 41.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.003 -0.544 . . . . 2.08 110.341 -175.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.662 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 10.9 ptt85 -66.68 -33.93 76.75 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.409 -0.36 . . . . 2.93 110.806 177.044 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -66.82 -50.29 63.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.48 -0.327 . . . . 1.21 110.739 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -65.67 -37.33 86.19 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.61 -0.268 . . . . 1.67 110.995 -176.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 66.9 mt -64.13 -57.85 8.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.843 0.354 . . . . 1.48 110.886 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.756 HG13 HD12 ' A' ' 80' ' ' LEU . 64.4 t -57.41 -49.99 78.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.053 -0.521 . . . . 0.82 111.541 -176.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.456 HD22 ' N ' ' A' ' 77' ' ' ASN . 0.9 OUTLIER -65.69 -42.89 90.68 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.959 -0.296 . . . . 1.14 111.57 -174.447 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 85.2 m -63.24 -53.98 44.47 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.852 0.316 . . . . 0.69 111.852 -176.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.4 mp -76.95 -51.1 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.81 0.338 . . . . 0.77 111.196 -177.109 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.871 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 15.4 mt -72.06 -15.16 62.02 Favored 'General case' 0 C--O 1.214 -0.8 0 N-CA-C 113.068 0.766 . . . . 0.78 113.068 -171.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 31.3 tttm -65.82 -56.11 13.61 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 119.163 0.892 . . . . 1.93 109.892 175.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.427 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 15.0 tm-20 -58.37 -32.58 68.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.323 -0.853 . . . . 2.91 109.499 176.059 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.66 ' HG2' HD23 ' A' ' 80' ' ' LEU . 6.0 tp10 -60.48 -53.74 53.88 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 114.912 -1.04 . . . . 1.66 111.11 176.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.871 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 45.4 mt -50.33 -30.65 12.56 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 114.276 -1.329 . . . . 0.58 112.059 178.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.427 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 30.7 mm-40 -51.79 -24.83 6.52 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 111.721 0.267 . . . . 0.92 111.721 -177.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.53 ' HB2' HD11 ' A' ' 29' ' ' ILE . 32.5 m-80 -94.07 -6.77 44.36 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.839 0.352 . . . . 1.02 111.417 -178.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 2.7 mt -120.26 151.18 22.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 109.891 -0.411 . . . . 0.77 109.891 -174.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -75.48 -45.81 36.18 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.267 -0.573 . . . . 1.85 109.721 175.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.67 117.26 3.99 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.024 -0.534 . . . . 0.78 110.18 177.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -116.02 122.35 44.95 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.108 -0.496 . . . . 0.63 110.669 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.7 p -115.33 129.5 56.62 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.322 -0.399 . . . . 1.27 110.253 176.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -107.33 139.49 41.72 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.162 0.506 . . . . 0.64 110.591 -178.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -108.14 111.03 22.84 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.088 -0.708 . . . . 2.23 109.088 176.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 45.8 t -83.23 116.14 22.26 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.339 -0.391 . . . . 1.38 110.354 -174.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.653 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 59.2 t60 -130.12 138.98 50.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.478 0.656 . . . . 1.98 110.35 -178.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -98.2 146.36 31.4 Favored Pre-proline 0 C--N 1.318 -0.803 0 CA-C-N 115.561 -0.745 . . . . 0.76 111.383 -179.364 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . 0.459 ' HA ' ' HB3' ' A' ' 100' ' ' TYR . 37.1 Cg_endo -67.14 -21.84 48.05 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.962 2.441 . . . . 0.72 112.808 -178.229 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -64.14 -51.29 64.59 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.045 -0.724 . . . . 2.08 109.045 177.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -70.76 -29.58 65.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.997 -0.547 . . . . 2.69 110.653 178.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.459 ' HB3' ' HA ' ' A' ' 97' ' ' PRO . 85.3 t80 -62.27 -41.05 98.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.197 -0.456 . . . . 1.46 110.662 178.14 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -60.97 -33.66 73.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 1.23 110.943 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.704 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.5 OUTLIER -71.6 -24.95 61.98 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.32 -0.4 . . . . 2.66 110.952 -179.552 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 86.1 mt . . . . . 0 C--N 1.327 -0.371 0 CA-C-N 116.36 -0.382 . . . . 1.31 110.25 178.605 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 43.4 t . . . . . 0 C--O 1.234 0.262 0 CA-C-O 120.603 0.239 . . . . 1.71 110.725 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.4 tp -52.5 -39.45 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 115.669 -0.696 . . . . 1.37 111.75 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -64.83 -39.32 93.38 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.199 0.523 . . . . 1.75 110.914 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.416 ' HB2' ' HE3' ' A' ' 27' ' ' LYS . 39.3 ttmt -70.34 -40.02 74.36 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.513 -0.767 . . . . 2.5 110.658 -177.075 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.3 t -66.21 -46.38 87.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.899 -0.591 . . . . 1.04 111.082 -178.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.58 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.5 mp -59.49 -49.3 84.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.79 111.44 -178.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.418 ' HG3' HD21 ' A' ' 44' ' ' LEU . 1.3 tm-20 -61.17 -39.14 89.01 Favored 'General case' 0 C--O 1.226 -0.177 0 N-CA-C 110.244 -0.28 . . . . 2.2 110.244 -177.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -64.2 -44.24 92.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.528 -0.305 . . . . 1.67 111.079 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -70.53 -55.48 8.79 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 112.343 0.498 . . . . 2.03 112.343 -173.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 3.3 pp -68.69 -29.3 67.72 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.433 -0.507 . . . . 0.57 111.498 -175.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.535 ' N ' HD12 ' A' ' 33' ' ' LEU . 55.0 m -73.4 -35.67 65.91 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.794 -0.362 . . . . 1.29 111.349 177.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.9 m -67.0 -27.46 67.44 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.851 -0.34 . . . . 0.78 111.092 176.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -92.38 -54.9 3.61 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 112.431 0.53 . . . . 0.64 112.431 -176.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.7 mt -79.46 -26.6 41.68 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.832 0.349 . . . . 0.94 110.673 -177.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 65.1 mttm 59.3 72.92 0.74 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.278 -0.874 . . . . 3.36 112.671 176.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.449 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 84.6 Cg_endo -91.29 165.71 3.62 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 122.876 2.384 . . . . 0.63 111.635 172.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 28.6 p -94.22 -32.27 13.75 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.038 0.446 . . . . 0.73 110.258 178.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.708 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 82.8 t80 -133.05 134.37 44.28 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.776 -0.647 . . . . 0.76 109.867 178.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -142.29 113.31 7.53 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.563 -0.532 . . . . 1.55 109.563 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -111.56 134.69 52.96 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.953 -0.388 . . . . 2.23 109.953 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.418 HD21 ' HG3' ' A' ' 30' ' ' GLU . 3.5 mm? -110.92 124.9 53.02 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.782 0.325 . . . . 1.72 110.944 -178.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 48.3 t -127.84 133.9 66.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.056 -0.52 . . . . 1.08 109.692 175.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.408 ' HA ' ' O ' ' A' ' 54' ' ' SER . 5.6 t70 -75.03 134.0 41.51 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 120.91 0.386 . . . . 1.83 110.164 175.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.9 tttt . . . . . 0 C--N 1.317 -0.827 0 CA-C-N 116.084 -0.507 . . . . 2.76 110.323 -178.125 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.408 ' O ' ' HA ' ' A' ' 46' ' ' ASP . 21.7 p . . . . . 0 N--CA 1.45 -0.438 0 N-CA-C 110.471 -0.196 . . . . 1.71 110.471 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -118.8 132.43 56.13 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 121.014 -0.274 . . . . 1.15 110.86 -178.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -113.0 113.02 24.89 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 107.754 -1.202 . . . . 1.35 107.754 171.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.0 117.88 35.17 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.172 0.511 . . . . 0.51 112.251 -169.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 61.1 t -83.64 112.28 20.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.675 -0.693 . . . . 0.55 109.641 175.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.673 HG13 ' HA ' ' A' ' 94' ' ' CYS . 1.0 OUTLIER -100.53 140.02 20.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.254 -0.43 . . . . 1.18 110.502 -176.051 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.708 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 95.1 t -127.98 107.44 16.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 108.864 -0.791 . . . . 0.58 108.864 171.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.449 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 43.5 t -155.78 154.87 32.07 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.073 0.463 . . . . 0.84 112.028 -174.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.49 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 0.8 OUTLIER -67.07 -19.47 65.67 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 115.558 -0.747 . . . . 1.67 110.333 173.98 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -58.02 -30.47 66.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.608 -0.724 . . . . 1.81 111.031 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -94.73 -11.1 29.73 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.185 0.517 . . . . 3.19 110.665 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.49 ' HB3' ' HA ' ' A' ' 62' ' ' ASN . 0.6 OUTLIER -91.42 -16.13 27.83 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 108.643 -0.873 . . . . 2.14 108.643 -176.962 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -74.22 0.64 13.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.374 -0.83 . . . . 2.03 109.843 175.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 53.3 mmtt 64.98 37.81 6.67 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 114.837 -1.074 . . . . 3.31 110.864 175.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.89 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 42.3 mmtm -96.1 92.07 6.25 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.063 -0.517 . . . . 1.99 111.148 177.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.411 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 5.8 tt -73.64 -57.29 4.09 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.436 -0.579 . . . . 2.33 109.436 177.438 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.433 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -68.18 -32.26 72.37 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.043 -0.526 . . . . 1.09 111.448 -177.388 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.89 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 24.3 t70 -74.09 -38.65 63.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.363 -0.38 . . . . 2.08 111.431 -173.164 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.411 ' HG2' ' O ' ' A' ' 69' ' ' LEU . 50.9 ptt85 -62.63 -34.54 77.26 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.422 -0.511 . . . . 2.93 109.851 177.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 73.4 t60 -69.05 -46.6 67.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.271 -0.422 . . . . 1.21 110.53 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.527 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 3.7 ptm180 -68.17 -38.77 82.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.659 -0.246 . . . . 1.67 110.884 -178.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -65.67 -47.58 75.03 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.833 -0.167 . . . . 1.48 111.028 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.519 HG13 HD22 ' A' ' 80' ' ' LEU . 37.2 t -57.51 -45.4 85.94 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 CA-C-N 116.567 -0.288 . . . . 0.82 110.665 177.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.543 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -67.35 -29.5 69.07 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.93 -0.308 . . . . 1.14 111.622 -179.031 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 91.5 m -66.25 -48.3 70.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.794 0.33 . . . . 0.69 111.019 -178.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 21.0 mt -81.8 -51.14 15.54 Favored 'Isoleucine or valine' 0 C--O 1.242 0.671 0 CA-C-O 121.952 0.882 . . . . 0.77 110.62 -177.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.954 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.3 mp -74.67 -0.13 16.97 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.195 -0.912 . . . . 0.78 111.27 -176.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.543 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 56.0 tptt -50.86 -63.71 1.04 Allowed 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 108.949 -0.76 . . . . 1.93 108.949 169.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -75.49 -35.68 60.76 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.906 -0.588 . . . . 2.91 110.968 176.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.954 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 30.7 tt0 -59.5 -41.18 89.29 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 111.868 0.321 . . . . 1.66 111.868 -175.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 41.0 mt -56.46 -30.68 63.2 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.185 0.439 . . . . 0.58 112.185 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -57.83 -18.23 20.97 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.72 0.295 . . . . 0.92 111.566 -174.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -100.27 -4.34 29.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.717 -0.22 . . . . 1.02 111.515 -177.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 6.1 mt -115.38 152.12 17.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 109.923 -0.399 . . . . 0.77 109.923 -177.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -84.43 -38.24 20.44 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.825 -0.435 . . . . 1.85 109.825 176.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -161.08 108.41 1.49 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.213 -0.449 . . . . 0.78 111.029 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -105.64 138.29 42.08 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.012 0.434 . . . . 0.63 110.869 176.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 44.5 m -134.61 158.84 43.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.872 -0.604 . . . . 1.27 109.485 175.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -137.0 147.56 46.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.22 0.533 . . . . 0.64 111.755 -176.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 48.7 mmtm -119.3 109.33 15.68 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.44 -0.8 . . . . 2.23 108.978 173.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.673 ' HA ' HG13 ' A' ' 59' ' ' ILE . 4.5 p -84.01 121.29 27.2 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.059 0.457 . . . . 1.38 111.315 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -131.79 153.88 49.67 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.333 0.587 . . . . 1.98 111.224 176.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 17.8 p -97.37 148.55 34.58 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.572 -0.74 . . . . 0.76 110.55 177.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -62.16 -30.25 81.86 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.621 2.214 . . . . 0.72 111.979 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.52 -51.34 60.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.667 -0.697 . . . . 2.08 109.965 -179.138 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.446 ' HA ' ' HE3' ' A' ' 102' ' ' LYS . 12.6 tp10 -72.57 -30.98 64.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.856 0.36 . . . . 2.69 110.489 -178.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -56.09 -35.21 66.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.864 -0.607 . . . . 1.46 111.595 -179.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -62.7 -36.57 83.37 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 121.094 -0.242 . . . . 1.23 111.031 -176.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.446 ' HE3' ' HA ' ' A' ' 99' ' ' GLU . 0.0 OUTLIER -66.62 -33.14 74.99 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.117 0.484 . . . . 2.66 110.495 178.16 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 69.1 mt . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 115.903 -0.589 . . . . 1.31 110.251 179.555 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 79.5 m . . . . . 0 N--CA 1.451 -0.404 0 N-CA-C 109.606 -0.516 . . . . 1.71 109.606 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.8 tp -54.8 -31.93 25.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 O-C-N 123.386 0.429 . . . . 1.37 111.414 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -58.6 -49.15 78.52 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.586 -0.279 . . . . 1.75 110.98 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.596 ' HE3' ' OE2' ' A' ' 30' ' ' GLU . 10.2 mmmm -70.91 -27.35 63.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.475 -0.33 . . . . 2.5 111.372 -177.025 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 81.8 t -58.82 -54.12 38.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.902 0.382 . . . . 1.04 110.067 176.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.509 HG12 HD11 ' A' ' 87' ' ' ILE . 1.8 mp -64.95 -48.78 82.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.615 -0.721 . . . . 0.79 110.509 178.336 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.596 ' OE2' ' HE3' ' A' ' 27' ' ' LYS . 27.1 tt0 -58.16 -52.21 66.5 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.966 -0.561 . . . . 2.2 111.461 -175.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -68.13 -31.98 71.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.542 -0.299 . . . . 1.67 111.299 -176.059 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -66.19 -55.66 15.18 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 120.588 0.233 . . . . 2.03 110.995 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 4.0 pp -72.8 -23.84 60.84 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.793 -0.363 . . . . 0.57 111.467 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.558 ' O ' ' HA ' ' A' ' 38' ' ' LYS . 22.7 t -69.08 -36.35 77.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.1 0.476 . . . . 1.29 110.131 176.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.3 m -71.68 -48.92 44.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.221 -0.445 . . . . 0.78 110.812 177.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.61 -54.76 6.84 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.614 0.598 . . . . 0.64 112.614 -173.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.8 mt -80.69 -33.41 35.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.937 0.398 . . . . 0.94 110.272 -177.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.558 ' HA ' ' O ' ' A' ' 34' ' ' SER . 18.7 ttmm 58.01 81.22 0.26 Allowed Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.045 -0.98 . . . . 3.36 112.154 174.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.697 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 5.4 Cg_endo -87.08 147.85 7.94 Favored 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 123.165 2.577 . . . . 0.63 112.197 178.321 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.22 -22.58 33.09 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.456 0.646 . . . . 0.73 109.794 176.122 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.679 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 64.4 t80 -141.63 127.6 19.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.235 -0.893 . . . . 0.76 109.156 171.164 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 48.6 tp -142.32 133.8 26.56 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.396 -0.366 . . . . 1.55 110.273 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -149.6 139.8 22.19 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.858 0.361 . . . . 2.23 110.536 174.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.416 HD22 ' N ' ' A' ' 44' ' ' LEU . 3.1 mm? -88.61 124.68 34.29 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.499 -0.556 . . . . 1.72 109.499 176.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 59.1 t -103.17 135.35 41.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.703 -0.48 . . . . 1.08 109.703 -178.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -69.41 105.01 2.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.905 -1.043 . . . . 1.83 111.082 -172.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.631 ' HE2' ' HB2' ' A' ' 56' ' ' ASP . 16.0 tppt? . . . . . 0 C--N 1.323 -0.554 0 CA-C-O 121.402 0.62 . . . . 2.76 109.705 179.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.5 m . . . . . 0 N--CA 1.448 -0.526 0 N-CA-C 109.968 -0.382 . . . . 1.71 109.968 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -136.39 143.36 43.95 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.592 -0.276 . . . . 1.15 110.481 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.631 ' HB2' ' HE2' ' A' ' 47' ' ' LYS . 38.7 t70 -122.0 115.27 22.22 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.016 -0.735 . . . . 1.35 109.016 175.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.03 119.42 39.14 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.026 0.441 . . . . 0.51 111.648 -171.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.514 ' HA ' ' HB2' ' A' ' 93' ' ' LYS . 62.2 t -75.71 111.25 11.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.229 -0.656 . . . . 0.55 109.229 175.223 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.521 HD11 ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER -113.67 110.53 32.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.911 0.862 . . . . 1.18 110.487 -176.782 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.679 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 98.2 t -107.81 106.44 20.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 114.747 -1.115 . . . . 0.58 108.945 175.596 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.697 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 40.4 t -151.55 155.13 37.84 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.344 0.592 . . . . 0.84 111.792 -173.118 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.526 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 0.8 OUTLIER -62.02 -19.23 62.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.971 -1.013 . . . . 1.67 111.66 176.269 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.439 ' OD1' ' HB3' ' A' ' 61' ' ' SER . 28.4 p-10 -63.78 -26.18 68.52 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.705 0.288 . . . . 1.81 111.285 -179.182 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.553 ' HD2' HG23 ' A' ' 96' ' ' THR . 59.6 t80 -90.63 -13.2 34.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.439 0.638 . . . . 3.19 109.674 176.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.526 ' HB3' ' HA ' ' A' ' 62' ' ' ASN . 0.9 OUTLIER -87.36 -11.03 50.54 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 108.878 -0.786 . . . . 2.14 108.878 -179.668 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -63.31 -19.46 64.62 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.029 -0.987 . . . . 2.03 110.451 178.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm 78.61 -28.28 0.16 Allowed 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.07 0.948 . . . . 3.31 111.883 176.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -71.24 100.03 2.02 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.929 0.395 . . . . 1.99 110.377 178.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.512 HD12 ' N ' ' A' ' 70' ' ' LEU . 4.0 pp -70.04 -36.31 74.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.277 -0.42 . . . . 2.33 111.432 -175.312 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.512 ' N ' HD12 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -67.79 -32.96 73.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.801 0.334 . . . . 1.09 110.942 178.951 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.522 ' HA ' ' HG2' ' A' ' 74' ' ' ARG . 7.2 m-20 -74.08 -37.73 64.13 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 120.888 0.375 . . . . 2.08 110.126 177.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -57.64 -43.3 84.77 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.377 -0.601 . . . . 2.93 109.377 172.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 30.7 t60 -63.42 -53.31 54.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.558 -0.746 . . . . 1.21 111.143 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.522 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 9.9 ptm180 -63.69 -36.6 84.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.3 -0.409 . . . . 1.67 111.6 -175.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -63.96 -49.48 72.34 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.77 0.319 . . . . 1.48 110.773 178.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 74.6 t -58.57 -42.82 85.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.069 -0.514 . . . . 0.82 110.297 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.536 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -64.3 -35.41 80.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.297 -0.41 . . . . 1.14 111.45 179.372 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 86.8 m -62.2 -51.33 68.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.838 0.351 . . . . 0.69 111.446 -178.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.4 HD12 ' N ' ' A' ' 79' ' ' ILE . 2.9 mp -80.03 -48.88 19.87 Favored 'Isoleucine or valine' 0 C--O 1.241 0.617 0 CA-C-O 121.44 0.638 . . . . 0.77 110.927 -177.295 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.893 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.5 mp -74.94 -2.27 26.28 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.933 -0.576 . . . . 0.78 111.441 -175.206 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.536 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 56.9 tptt -51.6 -64.1 0.92 Allowed 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 109.497 -0.557 . . . . 1.93 109.497 171.208 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.423 ' HG3' ' N ' ' A' ' 83' ' ' GLU . 2.4 pt-20 -75.07 -33.68 61.71 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.001 -0.545 . . . . 2.91 110.867 176.319 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.893 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 5.2 tp10 -55.18 -53.6 53.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.193 0.521 . . . . 1.66 112.049 -175.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 70.3 mt -50.39 -30.67 12.91 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.269 -0.878 . . . . 0.58 112.472 178.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -57.21 -24.34 53.9 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.023 0.44 . . . . 0.92 110.733 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -91.67 -10.82 38.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.064 -0.517 . . . . 1.02 111.47 -175.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.509 HD11 HG12 ' A' ' 29' ' ' ILE . 3.1 mt -120.46 164.13 17.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.746 -0.464 . . . . 0.77 109.746 -176.667 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -92.24 -46.36 7.76 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.505 -0.554 . . . . 1.85 109.505 175.163 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -148.3 109.6 4.36 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.032 -0.531 . . . . 0.78 110.514 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -116.77 127.41 54.32 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.295 -0.412 . . . . 0.63 110.547 177.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 37.0 p -124.44 167.07 14.92 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.412 -0.588 . . . . 1.27 109.412 175.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -143.51 146.01 33.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.919 0.39 . . . . 0.64 111.132 -178.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.514 ' HB2' ' HA ' ' A' ' 58' ' ' VAL . 44.5 mmtm -97.42 109.35 22.12 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.003 -0.74 . . . . 2.23 109.003 174.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 3.9 p -89.9 111.56 22.65 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.062 -0.517 . . . . 1.38 111.018 -174.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.464 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 1.7 m80 -138.3 156.82 47.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.985 -0.552 . . . . 1.98 110.671 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.553 HG23 ' HD2' ' A' ' 64' ' ' PHE . 47.5 p -98.16 153.47 38.09 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.225 -0.443 . . . . 0.76 110.272 177.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -64.39 -22.21 66.09 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.35 2.033 . . . . 0.72 111.191 175.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.402 HD22 ' HA ' ' A' ' 98' ' ' LEU . 1.4 tm? -68.56 -44.0 75.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.262 -0.881 . . . . 2.08 109.411 177.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 57.0 tt0 -75.9 -35.63 59.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.473 -0.785 . . . . 2.69 110.132 178.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -58.43 -32.49 68.74 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.931 -0.577 . . . . 1.46 110.957 178.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -52.03 -36.28 49.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.11 -0.495 . . . . 1.23 111.589 177.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -77.57 -35.43 53.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.101 0.477 . . . . 2.66 110.167 178.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 66.3 mt . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.748 -0.66 . . . . 1.31 111.709 -173.755 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.444 ' O ' HG23 ' A' ' 28' ' ' VAL . 62.3 m . . . . . 0 C--O 1.233 0.215 0 CA-C-O 120.761 0.315 . . . . 1.71 111.391 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.1 tp -61.64 -38.39 80.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 116.165 -0.47 . . . . 1.37 111.757 -176.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.2 tt0 -59.3 -43.11 92.65 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.086 0.469 . . . . 1.75 110.504 177.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.405 ' HD3' ' O ' ' A' ' 27' ' ' LYS . 11.7 tmtt? -64.75 -34.55 78.6 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.532 -0.758 . . . . 2.5 109.808 -179.176 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 24' ' ' CYS . 93.6 t -61.71 -43.95 97.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.993 -0.549 . . . . 1.04 110.49 176.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.508 HG13 ' HG3' ' A' ' 83' ' ' GLU . 1.7 mp -67.22 -42.93 88.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.17 -0.468 . . . . 0.79 110.535 178.213 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.537 ' O ' ' HB2' ' A' ' 34' ' ' SER . 45.1 mt-10 -52.21 -50.38 62.05 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.44 -0.345 . . . . 2.2 111.036 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.465 ' HA ' ' HB3' ' A' ' 34' ' ' SER . 4.6 m-20 -78.79 -18.98 53.24 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.249 0.463 . . . . 1.67 112.249 -178.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.458 ' HE3' HG23 ' A' ' 79' ' ' ILE . 51.5 tptt -61.46 -55.74 27.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.804 0.335 . . . . 2.03 110.21 178.443 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.517 HD11 ' HG ' ' A' ' 42' ' ' LEU . 4.4 pp -73.68 -26.38 60.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.229 -0.442 . . . . 0.57 110.429 176.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.604 ' O ' ' HD2' ' A' ' 38' ' ' LYS . 4.7 t -63.7 -45.96 87.63 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 116.169 -0.468 . . . . 1.29 109.907 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.8 m -53.27 -27.89 24.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.955 0.407 . . . . 0.78 111.231 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.615 ' HB2' HG12 ' A' ' 79' ' ' ILE . . . -89.22 -43.35 11.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.937 -0.574 . . . . 0.64 112.316 -177.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.0 mp -107.06 -36.13 6.68 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.461 0.541 . . . . 0.94 112.461 -173.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.604 ' HD2' ' O ' ' A' ' 34' ' ' SER . 27.9 mmmt 51.01 75.3 0.67 Allowed Pre-proline 0 N--CA 1.468 0.443 0 C-N-CA 123.3 0.64 . . . . 3.36 110.845 -168.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -81.97 141.66 12.01 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.716 2.277 . . . . 0.63 112.391 -178.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.4 p -60.95 -35.05 75.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.594 -0.73 . . . . 0.73 111.182 179.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.687 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 72.4 t80 -138.36 124.09 19.82 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.477 -0.564 . . . . 0.76 109.477 175.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.517 ' HG ' HD11 ' A' ' 33' ' ' LEU . 3.3 tm? -142.54 122.62 13.71 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.748 -0.834 . . . . 1.55 108.748 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.527 ' O ' ' HA ' ' A' ' 57' ' ' ALA . 10.7 tp10 -143.24 140.48 30.7 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.673 -0.411 . . . . 2.23 111.039 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.481 HD13 ' HG2' ' A' ' 30' ' ' GLU . 10.6 mp -106.74 117.41 33.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.086 0.47 . . . . 1.72 110.771 178.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 52.9 t -106.22 119.26 55.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.73 -0.668 . . . . 1.08 109.956 176.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -73.52 122.84 22.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.998 -0.546 . . . . 1.83 110.101 177.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.7 mtmm . . . . . 0 C--N 1.324 -0.509 0 CA-C-N 116.283 -0.417 . . . . 2.76 110.719 -177.986 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.7 p . . . . . 0 N--CA 1.446 -0.655 0 N-CA-C 109.29 -0.634 . . . . 1.71 109.29 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -111.33 132.7 54.2 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.184 0.516 . . . . 1.15 110.747 -175.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -112.59 118.55 35.4 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.191 -0.913 . . . . 1.35 108.589 176.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.527 ' HA ' ' O ' ' A' ' 43' ' ' GLU . . . -105.68 115.6 30.52 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.999 0.428 . . . . 0.51 111.68 -173.404 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.413 ' O ' ' HA ' ' A' ' 42' ' ' LEU . 47.3 t -74.43 110.93 9.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 108.589 -0.893 . . . . 0.55 108.589 172.389 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -107.65 109.68 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 CA-C-O 121.862 0.839 . . . . 1.18 109.963 -177.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.687 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 60.2 t -111.26 105.21 18.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 115.026 -0.988 . . . . 0.58 110.088 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 88.2 p -156.75 142.18 17.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.231 0.539 . . . . 0.84 111.238 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.644 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 61.4 m-20 -67.69 -18.49 64.94 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.372 -0.831 . . . . 1.67 112.07 177.529 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -48.99 -36.83 18.53 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.878 0.371 . . . . 1.81 111.029 177.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.603 ' CE1' ' HA ' ' A' ' 72' ' ' ARG . 21.3 m-30 -101.59 21.4 14.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.955 0.407 . . . . 3.19 111.286 -178.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.644 ' HB3' ' O ' ' A' ' 62' ' ' ASN . 0.7 OUTLIER -92.95 -14.57 27.34 Favored 'General case' 0 N--CA 1.426 -1.658 0 N-CA-C 108.407 -0.96 . . . . 2.14 108.407 178.847 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -73.21 -4.02 30.39 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.365 -0.834 . . . . 2.03 109.916 178.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 99.2 mttt 67.45 25.32 8.57 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.359 -0.837 . . . . 3.31 111.888 172.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.524 ' HE2' HD11 ' A' ' 70' ' ' LEU . 13.5 mmmm -93.08 96.53 10.11 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.852 -0.613 . . . . 1.99 109.896 178.172 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.471 HD12 ' N ' ' A' ' 70' ' ' LEU . 4.3 pp -72.35 -33.16 67.08 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.968 -0.293 . . . . 2.33 110.977 -175.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.524 HD11 ' HE2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -67.88 -35.16 78.02 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 120.957 -0.297 . . . . 1.09 110.682 177.662 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.521 ' N ' HD22 ' A' ' 70' ' ' LEU . 23.0 m-20 -71.66 -45.32 62.32 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 109.567 -0.531 . . . . 2.08 109.567 175.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.603 ' HA ' ' CE1' ' A' ' 64' ' ' PHE . 0.5 OUTLIER -52.88 -48.07 67.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.476 -0.784 . . . . 2.93 110.033 175.497 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.6 t60 -65.94 -53.03 44.49 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.721 -0.672 . . . . 1.21 111.315 -177.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -67.04 -41.65 86.17 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 111.961 0.356 . . . . 1.67 111.961 -172.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.99 -49.98 70.33 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.929 0.395 . . . . 1.48 110.315 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.776 HG13 HD22 ' A' ' 80' ' ' LEU . 35.0 t -57.74 -46.55 86.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.701 -0.681 . . . . 0.82 110.635 178.188 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -61.84 -40.24 94.62 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.611 -0.268 . . . . 1.14 111.583 -178.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 74.8 m -60.99 -51.22 70.17 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 111.626 0.232 . . . . 0.69 111.626 -177.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.615 HG12 ' HB2' ' A' ' 36' ' ' ALA . 2.7 mp -81.12 -48.84 18.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 CA-C-O 120.9 0.381 . . . . 0.77 111.295 -176.088 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.86 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.0 mp -69.8 -7.44 39.83 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 116.208 -0.451 . . . . 0.78 111.669 -176.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -55.51 -59.71 4.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.273 0.559 . . . . 1.93 109.951 171.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -68.64 -37.38 79.65 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.608 -0.724 . . . . 2.91 110.178 177.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.86 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 32.9 tt0 -55.27 -41.22 71.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.743 -0.662 . . . . 1.66 111.285 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.727 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 57.3 mt -54.84 -30.99 58.88 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 123.082 0.553 . . . . 0.58 112.402 179.426 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -60.2 -18.49 48.65 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.734 0.302 . . . . 0.92 111.3 -174.149 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.503 ' HB2' HD11 ' A' ' 29' ' ' ILE . 25.8 m-80 -101.8 4.86 40.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.815 0.34 . . . . 1.02 110.929 -178.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 3.3 mt -127.32 163.81 29.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 110.102 -0.332 . . . . 0.77 110.102 -175.344 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -96.55 -52.23 4.02 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.619 -0.511 . . . . 1.85 109.619 173.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -144.4 101.15 3.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.922 -0.581 . . . . 0.78 110.311 177.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -93.31 141.47 28.4 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.279 -0.419 . . . . 0.63 110.944 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.5 m -138.38 163.58 31.5 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.742 -0.836 . . . . 1.27 108.742 175.032 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -146.06 151.56 37.92 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.57 -0.452 . . . . 0.64 111.61 -178.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -113.81 116.32 29.16 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.56 -0.746 . . . . 2.23 109.481 176.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 42.5 t -84.23 124.19 30.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.71 0.29 . . . . 1.38 110.724 -177.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.666 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 2.1 t60 -147.99 152.72 37.95 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.868 -0.419 . . . . 1.98 109.868 179.122 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.489 HG21 ' HB2' ' A' ' 65' ' ' GLU . 0.8 OUTLIER -102.19 151.89 38.16 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-O 120.76 0.314 . . . . 0.76 111.838 178.113 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -59.36 -48.04 14.96 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.999 2.466 . . . . 0.72 112.247 -177.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.29 -36.12 81.13 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.83 -0.623 . . . . 2.08 111.199 -177.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.562 ' HA ' ' CE ' ' A' ' 102' ' ' LYS . 20.1 tp10 -75.72 -38.51 58.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.773 0.32 . . . . 2.69 110.627 -178.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -65.38 -33.25 75.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.871 0.367 . . . . 1.46 110.093 176.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -54.48 -43.75 72.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.578 -0.737 . . . . 1.23 111.591 178.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.562 ' CE ' ' HA ' ' A' ' 99' ' ' GLU . 0.0 OUTLIER -61.99 -47.78 83.29 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 120.899 -0.32 . . . . 2.66 110.708 177.72 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 62.4 mt . . . . . 0 C--N 1.324 -0.513 0 CA-C-N 116.181 -0.463 . . . . 1.31 111.309 -176.003 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 34.7 m . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.599 0.238 . . . . 1.71 110.814 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.3 tp -55.01 -34.15 30.89 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 CA-C-N 116.201 -0.454 . . . . 1.37 111.157 -178.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 21.2 tm0? -58.83 -47.4 84.94 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.593 -0.276 . . . . 1.75 110.317 177.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.573 ' HA ' ' HB3' ' A' ' 30' ' ' GLU . 53.1 mttt -71.74 -17.82 62.17 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 116.426 -0.352 . . . . 2.5 111.671 -178.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 95.3 t -67.25 -51.1 56.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 109.174 -0.676 . . . . 1.04 109.174 174.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.591 ' HA ' ' OE2' ' A' ' 83' ' ' GLU . 2.0 mp -61.29 -51.33 74.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 115.135 -0.939 . . . . 0.79 109.646 174.559 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.573 ' HB3' ' HA ' ' A' ' 27' ' ' LYS . 34.1 tt0 -53.06 -51.77 60.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.303 -0.862 . . . . 2.2 111.564 -178.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -61.87 -45.52 93.41 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.974 -0.557 . . . . 1.67 111.799 -174.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -68.42 -47.52 67.03 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.378 -0.529 . . . . 2.03 112.24 -175.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.486 HD12 ' N ' ' A' ' 34' ' ' SER . 4.2 pp -70.8 -27.69 64.08 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.095 -0.642 . . . . 0.57 110.987 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.486 ' N ' HD12 ' A' ' 33' ' ' LEU . 46.5 t -66.66 -46.34 76.03 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.937 -0.394 . . . . 1.29 109.937 175.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.8 m -71.35 -27.73 63.56 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.297 -0.41 . . . . 0.78 111.337 -179.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.61 -43.17 20.96 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.082 0.401 . . . . 0.64 112.082 -176.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 85.8 mt -104.46 -38.05 6.95 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.724 0.268 . . . . 0.94 111.724 -174.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.3 mttm 53.6 90.37 0.09 OUTLIER Pre-proline 0 N--CA 1.467 0.384 0 CA-C-O 121.647 0.737 . . . . 3.36 112.642 -175.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.75 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 5.2 Cg_endo -87.74 158.73 7.62 Favored 'Trans proline' 0 N--CA 1.451 -1.022 0 C-N-CA 123.155 2.57 . . . . 0.63 112.047 175.024 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 21.6 p -82.77 -26.19 32.08 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.742 0.782 . . . . 0.73 109.031 173.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.57 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 91.6 t80 -140.1 132.33 28.17 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.695 -1.139 . . . . 0.76 109.268 173.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.571 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 59.3 tp -136.18 122.64 20.74 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.941 -0.392 . . . . 1.55 109.941 -179.063 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.519 ' HB3' ' HB ' ' A' ' 58' ' ' VAL . 34.9 tt0 -119.88 119.86 34.75 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.432 -0.349 . . . . 2.23 110.061 -179.284 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -104.09 115.85 31.16 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.023 -0.362 . . . . 1.72 110.023 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 50.1 t -121.91 124.71 71.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.632 -0.258 . . . . 1.08 110.762 -178.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -82.07 122.63 28.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.113 0.482 . . . . 1.83 109.984 174.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt . . . . . 0 C--N 1.319 -0.758 0 CA-C-N 115.874 -0.603 . . . . 2.76 110.538 -178.487 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.526 ' HB3' ' O ' ' A' ' 89' ' ' ALA . 68.6 m . . . . . 0 N--CA 1.45 -0.431 0 N-CA-C 108.969 -0.752 . . . . 1.71 108.969 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.463 ' HB2' ' CD1' ' A' ' 90' ' ' PHE . 81.2 m-85 -111.57 132.66 54.39 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.599 0.714 . . . . 1.15 111.385 -170.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -110.81 113.85 26.75 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 107.702 -1.221 . . . . 1.35 107.702 173.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.34 116.12 31.39 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.298 0.571 . . . . 0.51 111.382 -173.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.519 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 44.8 t -83.61 111.12 19.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 108.791 -0.818 . . . . 0.55 108.791 174.462 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.438 HG23 ' HA ' ' A' ' 94' ' ' CYS . 0.0 OUTLIER -110.14 107.84 23.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 121.876 0.846 . . . . 1.18 110.553 -176.207 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.57 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 94.4 t -107.72 108.01 24.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 114.86 -1.063 . . . . 0.58 109.013 176.253 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.75 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 45.2 t -151.36 154.78 37.35 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.254 0.549 . . . . 0.84 112.112 -173.175 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.491 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 14.9 m120 -66.53 -19.44 65.78 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.233 -0.894 . . . . 1.67 110.27 174.126 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -64.69 -20.79 66.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.916 -0.584 . . . . 1.81 110.537 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -110.47 7.01 22.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.36 0.6 . . . . 3.19 110.042 178.103 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.491 ' HB3' ' O ' ' A' ' 62' ' ' ASN . 0.5 OUTLIER -76.69 -28.34 55.88 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 109.347 -0.612 . . . . 2.14 109.347 -177.008 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -71.72 -8.57 54.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.815 -0.63 . . . . 2.03 110.225 172.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 54.6 mttp 65.73 29.44 10.7 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.384 -0.826 . . . . 3.31 112.165 171.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.443 ' HB3' ' OD2' ' A' ' 71' ' ' ASP . 14.2 mmmm -90.71 96.11 10.48 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.024 0.44 . . . . 1.99 109.974 175.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.444 HD12 ' N ' ' A' ' 70' ' ' LEU . 3.8 pp -73.48 -36.77 65.86 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.98 -0.555 . . . . 2.33 111.521 -174.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.455 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.87 -32.26 72.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.717 0.294 . . . . 1.09 110.972 178.496 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.455 ' N ' HD22 ' A' ' 70' ' ' LEU . 4.1 m-20 -66.84 -49.39 65.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.914 0.388 . . . . 2.08 110.666 -179.533 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.43 ' HG3' ' O ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -66.08 -26.83 67.66 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.827 -0.349 . . . . 2.93 110.344 178.724 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -69.51 -50.03 49.01 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 116.278 -0.419 . . . . 1.21 111.001 -179.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 11.6 ptm180 -66.7 -36.31 82.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.66 -0.245 . . . . 1.67 111.169 -178.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.84 -50.59 55.83 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 120.711 0.291 . . . . 1.48 111.034 177.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.539 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 8.9 p -61.77 -35.4 67.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.298 0 CA-C-N 116.496 -0.32 . . . . 0.82 110.25 -179.087 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.601 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -69.62 -33.66 72.96 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.625 -0.261 . . . . 1.14 110.996 177.741 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 66.8 m -59.48 -51.72 68.66 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.707 0.289 . . . . 0.69 111.344 179.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.0 mp -83.18 -47.55 18.2 Favored 'Isoleucine or valine' 0 C--O 1.244 0.796 0 CA-C-O 121.681 0.753 . . . . 0.77 111.149 -177.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.805 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.3 mp -77.31 -0.45 25.54 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.176 -0.466 . . . . 0.78 112.121 -173.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.601 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 56.9 tptt -58.68 -57.77 11.54 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.26 -0.644 . . . . 1.93 109.26 171.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -72.15 -34.12 68.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.3 -0.863 . . . . 2.91 109.99 177.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.805 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.7 tp10 -54.86 -51.03 67.21 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.628 -0.714 . . . . 1.66 112.468 178.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.732 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 52.7 mt -50.35 -30.42 12.15 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.283 -0.871 . . . . 0.58 113.252 -176.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -53.73 -19.63 4.43 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.269 0.47 . . . . 0.92 112.269 -174.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -101.86 -4.0 27.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.77 0.319 . . . . 1.02 111.54 -177.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.498 HD11 HG12 ' A' ' 29' ' ' ILE . 12.6 mt -114.94 151.7 16.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.482 -0.326 . . . . 0.77 110.136 -174.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -84.99 -55.23 4.16 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.804 -0.358 . . . . 1.85 110.099 177.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.526 ' O ' ' HB3' ' A' ' 54' ' ' SER . . . -144.16 91.22 2.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.937 0.399 . . . . 0.78 111.185 178.292 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . 0.463 ' CD1' ' HB2' ' A' ' 55' ' ' PHE . 63.7 t80 -86.4 141.41 29.18 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.323 -0.399 . . . . 0.63 110.002 177.067 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 8.8 m -141.04 158.56 43.77 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.372 -0.603 . . . . 1.27 109.372 177.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -138.65 147.14 42.51 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.932 0.396 . . . . 0.64 111.124 -179.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -115.97 109.54 17.71 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.664 -0.698 . . . . 2.23 109.725 175.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.438 ' HA ' HG23 ' A' ' 59' ' ' ILE . 7.9 p -85.6 123.82 31.45 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.719 0.295 . . . . 1.38 110.623 -177.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.494 ' HD2' ' HG2' ' A' ' 99' ' ' GLU . 3.7 m80 -144.0 160.52 40.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.165 0.507 . . . . 1.98 110.99 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.424 ' CG2' ' HA ' ' A' ' 65' ' ' GLU . 11.5 p -102.75 153.69 38.03 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 115.489 -0.778 . . . . 0.76 111.132 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -58.12 -28.76 84.9 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.721 2.281 . . . . 0.72 111.69 175.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.53 -47.16 76.75 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.896 -0.593 . . . . 2.08 110.285 177.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.494 ' HG2' ' HD2' ' A' ' 95' ' ' HIS . 6.4 tp10 -67.05 -51.82 49.82 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.629 -0.714 . . . . 2.69 110.657 179.38 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -62.11 -32.39 72.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.917 -0.583 . . . . 1.46 110.966 -176.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -55.42 -33.24 63.37 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.035 -0.53 . . . . 1.23 111.072 178.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.42 ' N ' ' HE3' ' A' ' 102' ' ' LYS . 0.6 OUTLIER -76.55 -43.51 38.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.971 0.415 . . . . 2.66 110.223 176.8 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 86.2 mt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 115.799 -0.637 . . . . 1.31 111.492 -175.838 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.509 ' O ' HG23 ' A' ' 28' ' ' VAL . 42.4 t . . . . . 0 N--CA 1.454 -0.232 0 N-CA-C 108.646 -0.872 . . . . 1.71 108.646 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.552 ' O ' HG12 ' A' ' 29' ' ' ILE . 8.7 tp -53.07 -38.2 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 O-C-N 123.501 0.501 . . . . 1.37 111.626 -175.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -62.01 -52.26 64.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.807 0.337 . . . . 1.75 110.614 179.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -64.97 -31.45 72.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.101 -0.5 . . . . 2.5 110.774 -178.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 24' ' ' CYS . 89.5 t -61.79 -46.45 96.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 110.125 -0.324 . . . . 1.04 110.125 175.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.599 HG21 HD11 ' A' ' 87' ' ' ILE . 51.3 mm -63.14 -43.07 98.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.132 -0.486 . . . . 0.79 110.342 177.283 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -54.18 -51.94 62.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.982 -0.553 . . . . 2.2 111.005 177.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.418 ' HA ' ' HG ' ' A' ' 34' ' ' SER . 16.5 t70 -67.65 -34.55 77.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.183 0.516 . . . . 1.67 111.007 -179.55 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.541 ' HG2' ' OE1' ' A' ' 83' ' ' GLU . 13.5 tptp -60.18 -55.89 28.31 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.517 -0.765 . . . . 2.03 111.388 -177.423 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -74.16 -29.76 61.93 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.984 -0.286 . . . . 0.57 111.722 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.418 ' HG ' ' HA ' ' A' ' 31' ' ' ASP . 73.6 p -72.04 -33.4 67.97 Favored 'General case' 0 C--O 1.224 -0.248 0 C-N-CA 121.089 -0.244 . . . . 1.29 111.241 -177.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.2 m -65.79 -27.32 68.19 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.826 0.346 . . . . 0.78 111.042 176.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.29 -49.47 6.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.385 -0.37 . . . . 0.64 111.672 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.6 mt -83.11 -30.15 28.16 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.855 0.317 . . . . 0.94 111.855 -177.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 16.3 mmtm 55.68 81.82 0.25 Allowed Pre-proline 0 N--CA 1.466 0.329 0 C-N-CA 123.175 0.59 . . . . 3.36 112.331 -176.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.589 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 69.0 Cg_endo -92.62 139.23 1.81 Allowed 'Trans proline' 0 N--CA 1.448 -1.195 0 C-N-CA 122.887 2.392 . . . . 0.63 111.947 174.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 13.7 p -68.41 -32.5 72.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.22 0.533 . . . . 0.73 110.298 176.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.502 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 69.1 t80 -141.97 131.76 24.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.491 -0.777 . . . . 0.76 109.472 176.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.7 tp -141.87 112.87 7.41 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.756 0.312 . . . . 1.55 110.535 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -125.74 139.17 53.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.493 -0.321 . . . . 2.23 110.322 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.5 ' HG ' ' HB2' ' A' ' 57' ' ' ALA . 7.2 mp -117.12 122.41 44.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.541 -0.3 . . . . 1.72 110.497 -178.434 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.507 HG23 ' HB3' ' A' ' 56' ' ' ASP . 9.6 m -112.75 150.79 14.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.017 0.437 . . . . 1.08 111.135 178.115 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -78.28 119.58 21.84 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.793 -0.64 . . . . 1.83 110.235 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 21.5 ttmm . . . . . 0 C--N 1.324 -0.534 0 CA-C-N 116.223 -0.444 . . . . 2.76 109.862 -179.893 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.0 p . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 120.733 0.301 . . . . 1.71 110.711 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -111.63 132.74 54.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.415 -0.357 . . . . 1.15 110.621 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.507 ' HB3' HG23 ' A' ' 45' ' ' VAL . 5.2 t70 -107.76 110.37 22.17 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.33 -0.619 . . . . 1.35 109.33 179.08 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.5 ' HB2' ' HG ' ' A' ' 44' ' ' LEU . . . -106.17 115.8 30.84 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.99 0.424 . . . . 0.51 111.315 -177.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 56.2 t -82.02 111.18 18.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.81 -0.632 . . . . 0.55 109.32 175.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.431 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -104.41 108.8 25.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.667 0.746 . . . . 1.18 110.13 -176.971 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.612 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 60.4 t -106.5 106.67 21.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.175 -0.92 . . . . 0.58 109.27 177.13 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.589 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 30.0 t -142.31 147.93 37.17 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.012 0.434 . . . . 0.84 112.081 -174.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.626 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 25.0 m120 -67.13 -20.68 65.8 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.5 -0.773 . . . . 1.67 110.891 174.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -61.51 -23.96 66.28 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.939 -0.573 . . . . 1.81 111.154 -177.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -100.65 -5.3 26.82 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.476 -0.329 . . . . 3.19 111.477 -175.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.626 ' HG2' ' O ' ' A' ' 62' ' ' ASN . 7.7 pt-20 -77.58 -2.17 34.42 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 120.401 -0.52 . . . . 2.14 111.457 -174.11 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -92.86 4.49 53.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.227 0.536 . . . . 2.03 109.939 176.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt 71.82 15.21 5.85 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.18 -0.918 . . . . 3.31 111.062 175.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.427 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 44.0 mmtm -76.39 89.7 3.21 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.195 0.522 . . . . 1.99 110.963 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -73.92 -50.01 22.09 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.609 -0.723 . . . . 2.33 109.899 179.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.521 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.61 -34.58 77.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.117 -0.492 . . . . 1.09 111.215 -175.754 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.521 ' N ' HD22 ' A' ' 70' ' ' LEU . 9.4 t70 -73.76 -37.03 65.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.316 0.579 . . . . 2.08 109.878 -178.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.425 ' O ' HG23 ' A' ' 76' ' ' VAL . 1.3 tmt_? -63.42 -41.88 98.71 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.752 -0.658 . . . . 2.93 110.018 172.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -63.02 -47.01 84.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.089 -0.505 . . . . 1.21 111.155 -178.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 3.5 ptm180 -66.18 -35.66 81.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.466 -0.334 . . . . 1.67 110.963 -177.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.84 -48.34 71.96 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 110.244 -0.28 . . . . 1.48 110.244 176.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.531 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 64.6 t -56.92 -42.49 78.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.083 -0.508 . . . . 0.82 110.678 177.292 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.407 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -64.91 -42.95 94.31 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.989 -0.284 . . . . 1.14 111.548 179.286 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 57.4 m -65.92 -49.09 69.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.03 0.443 . . . . 0.69 111.349 -176.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.428 ' HB ' HD12 ' A' ' 80' ' ' LEU . 35.1 mt -72.4 -53.37 19.66 Favored 'Isoleucine or valine' 0 C--O 1.241 0.643 0 CA-C-O 121.742 0.782 . . . . 0.77 110.708 -178.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 1.053 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.4 mp -79.57 -0.31 33.05 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.175 -0.92 . . . . 0.78 111.965 -172.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 17.8 tppt? -53.81 -63.92 0.99 Allowed 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.475 -0.49 . . . . 1.93 109.688 173.066 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -75.76 -33.08 60.21 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.096 -0.502 . . . . 2.91 110.884 173.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 1.053 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 1.8 tp10 -52.83 -52.88 55.35 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.787 0.327 . . . . 1.66 111.683 -177.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 61.9 mt -50.49 -30.83 13.71 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.48 -0.782 . . . . 0.58 112.465 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -57.81 -22.38 47.15 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 120.745 0.307 . . . . 0.92 111.077 -177.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -90.47 -7.01 54.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.811 0.338 . . . . 1.02 111.174 -178.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.599 HD11 HG21 ' A' ' 29' ' ' ILE . 6.9 mt -123.72 135.45 63.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.504 -0.316 . . . . 0.77 110.498 -174.283 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -69.33 -46.74 66.34 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.561 -0.533 . . . . 1.85 109.561 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -151.94 101.36 2.73 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.239 -0.437 . . . . 0.78 110.947 178.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . 0.506 ' HB2' HG21 ' A' ' 87' ' ' ILE . 79.1 t80 -103.01 139.28 38.77 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.944 0.402 . . . . 0.63 111.028 178.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.7 m -135.19 149.49 49.94 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.32 -0.622 . . . . 1.27 109.32 174.45 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -134.42 134.23 41.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.106 0.479 . . . . 0.64 111.105 -178.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -106.48 116.74 32.46 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.805 -0.634 . . . . 2.23 109.377 177.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 7.2 p -83.62 129.39 34.96 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.016 0.436 . . . . 1.38 111.613 -175.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.612 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 0.1 OUTLIER -145.09 158.23 43.88 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.802 -0.636 . . . . 1.98 109.67 176.063 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.403 ' HA ' ' HD3' ' A' ' 97' ' ' PRO . 0.6 OUTLIER -112.03 153.99 44.39 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 116.413 -0.358 . . . . 0.76 111.627 -178.507 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 96' ' ' THR . 27.5 Cg_exo -61.89 -26.86 79.48 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 123.11 2.54 . . . . 0.72 112.724 -176.241 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 98' ' ' LEU . 1.2 tm? -62.45 -51.41 67.62 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.777 -0.453 . . . . 2.08 109.777 -178.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.563 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 6.4 mp0 -66.82 -38.8 87.17 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.38 -0.373 . . . . 2.69 111.0 177.168 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -59.42 -39.72 84.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.586 -0.279 . . . . 1.46 111.05 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -58.46 -34.43 70.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 1.23 110.524 179.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.703 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.6 OUTLIER -76.44 -35.47 58.48 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.399 -0.364 . . . . 2.66 110.537 178.455 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.563 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 69.8 mt . . . . . 0 N--CA 1.463 0.206 0 CA-C-N 115.94 -0.573 . . . . 1.31 111.396 -178.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 37.8 m . . . . . 0 N--CA 1.451 -0.401 0 N-CA-C 109.788 -0.449 . . . . 1.71 109.788 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 11.2 tp -61.24 -32.03 51.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.611 0.243 . . . . 1.37 110.899 -176.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.461 ' HA ' ' OE1' ' A' ' 26' ' ' GLN . 6.4 tp60 -63.14 -37.2 86.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.97 0.414 . . . . 1.75 110.683 179.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -71.59 -33.8 69.33 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.226 -0.443 . . . . 2.5 110.054 177.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.43 HG12 ' HE3' ' A' ' 32' ' ' LYS . 62.2 t -61.45 -50.91 78.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.968 -0.56 . . . . 1.04 110.194 177.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.483 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.7 mp -58.39 -50.21 79.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.804 -0.635 . . . . 0.79 110.149 176.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -53.46 -52.03 60.81 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.727 -0.669 . . . . 2.2 111.579 -178.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.8 -42.22 77.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 1.67 112.138 -173.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.43 ' HE3' HG12 ' A' ' 28' ' ' VAL . 8.4 mtmp? -66.88 -45.71 77.19 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.595 -0.442 . . . . 2.03 111.564 -175.127 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 4.5 pp -72.31 -28.27 62.97 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.197 -0.601 . . . . 0.57 110.999 177.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.443 ' N ' HD12 ' A' ' 33' ' ' LEU . 46.3 t -66.0 -41.82 90.56 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.982 0.42 . . . . 1.29 109.901 175.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.7 m -66.93 -27.65 67.65 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.111 0.482 . . . . 0.78 110.686 179.021 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.496 ' HB2' HG12 ' A' ' 79' ' ' ILE . . . -77.15 -53.91 7.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.807 -0.633 . . . . 0.64 111.87 -178.613 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.3 mt -86.79 -26.38 24.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.439 -0.346 . . . . 0.94 111.465 -174.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.2 tttp 56.67 75.12 0.6 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.771 -0.65 . . . . 3.36 110.964 -176.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.539 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 23.5 Cg_endo -94.45 144.47 1.66 Allowed 'Trans proline' 0 N--CA 1.448 -1.154 0 C-N-CA 123.29 2.66 . . . . 0.63 112.566 179.141 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 23.9 p -80.58 -23.76 39.66 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.424 0.63 . . . . 0.73 109.489 174.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.775 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 76.5 t80 -139.25 125.21 19.81 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.005 -0.998 . . . . 0.76 109.248 175.272 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -142.23 118.73 10.94 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.323 -0.621 . . . . 1.55 109.323 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -131.55 131.89 43.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.518 -0.31 . . . . 2.23 110.908 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -89.55 115.59 27.07 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.975 -0.75 . . . . 1.72 108.975 176.004 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 44.6 t -107.17 132.21 55.19 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.024 0.44 . . . . 1.08 111.502 -175.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.28 100.93 0.38 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.515 -0.766 . . . . 1.83 109.255 172.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.515 ' HD3' ' HB3' ' A' ' 56' ' ' ASP . 27.4 tptt . . . . . 0 C--N 1.324 -0.538 0 CA-C-O 121.013 0.435 . . . . 2.76 109.985 -176.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.0 m . . . . . 0 N--CA 1.451 -0.407 0 N-CA-C 110.142 -0.318 . . . . 1.71 110.142 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -111.55 132.42 54.54 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.719 -0.845 . . . . 1.15 108.719 175.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.515 ' HB3' ' HD3' ' A' ' 47' ' ' LYS . 35.1 t70 -115.56 125.94 53.6 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.947 -0.39 . . . . 1.35 109.947 -175.183 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.15 115.95 31.1 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.199 0.523 . . . . 0.51 111.273 -174.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 62.0 t -78.09 111.85 15.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.391 -0.822 . . . . 0.55 109.061 174.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.543 ' CG1' ' HA ' ' A' ' 94' ' ' CYS . 0.9 OUTLIER -105.16 133.89 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-O 121.234 0.54 . . . . 1.18 110.356 -177.559 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.775 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 96.9 t -124.91 101.48 8.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 N-CA-C 108.618 -0.882 . . . . 0.58 108.618 172.125 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.539 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 37.1 t -151.7 154.97 37.37 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.186 -0.461 . . . . 0.84 111.376 -173.211 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.46 -18.97 65.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.935 -0.575 . . . . 1.67 110.519 174.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -63.42 -1.93 1.34 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 122.804 0.442 . . . . 1.81 112.022 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.594 ' HD2' HG23 ' A' ' 96' ' ' THR . 51.6 t80 -109.69 -7.14 15.12 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.983 -0.448 . . . . 3.19 111.528 179.643 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -75.5 -18.2 59.9 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.688 -0.405 . . . . 2.14 111.606 -171.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.5 ' O ' ' HG2' ' A' ' 67' ' ' LYS . 8.7 m-20 -75.59 -15.41 60.36 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.828 -0.169 . . . . 2.03 110.847 175.49 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 66' ' ' ASP . 62.3 pttt 53.6 13.85 0.53 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.759 1.224 . . . . 3.31 113.21 178.482 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -78.82 125.32 29.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.209 0.528 . . . . 1.99 111.276 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 28.0 tp -69.7 -56.67 6.57 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.311 -0.858 . . . . 2.33 111.1 -179.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.98 -31.16 72.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.717 -0.674 . . . . 1.09 112.125 -171.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.418 ' O ' ' HG2' ' A' ' 74' ' ' ARG . 12.4 t70 -73.76 -45.46 51.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.056 0.455 . . . . 2.08 110.636 -174.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 72' ' ' ARG . 12.9 ptt180 -72.49 -31.78 65.65 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.658 -0.497 . . . . 2.93 109.658 178.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -60.67 -50.93 71.54 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.086 -0.506 . . . . 1.21 110.349 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.418 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 6.2 ptm180 -63.88 -40.46 96.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.52 -0.309 . . . . 1.67 111.23 -178.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 89.0 mt -65.09 -50.24 66.89 Favored 'General case' 0 C--O 1.243 0.715 0 CA-C-O 121.122 0.486 . . . . 1.48 110.754 179.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.538 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 47.1 t -55.65 -45.34 78.99 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.586 0 CA-C-N 115.494 -0.776 . . . . 0.82 110.568 178.093 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.405 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 12.7 m120 -66.96 -27.37 67.4 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 121.007 -0.277 . . . . 1.14 111.431 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 96.4 m -63.19 -54.02 44.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.541 0.21 . . . . 0.69 110.943 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.496 HG12 ' HB2' ' A' ' 36' ' ' ALA . 3.3 mp -82.19 -42.29 18.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 CA-C-O 121.63 0.728 . . . . 0.77 111.006 -178.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.878 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.5 mp -76.49 -0.99 25.04 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.041 -0.527 . . . . 0.78 111.757 -176.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 51.5 tptt -51.56 -63.37 1.15 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.379 -0.6 . . . . 1.93 109.379 169.503 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -74.63 -34.9 62.88 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.162 -0.472 . . . . 2.91 110.989 176.3 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.878 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 5.5 tp10 -52.55 -55.4 22.48 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.387 0.613 . . . . 1.66 111.975 -178.537 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 65.8 mt -50.51 -30.87 13.92 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 115.174 -0.921 . . . . 0.58 112.756 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -56.64 -23.15 39.37 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.901 0.381 . . . . 0.92 111.098 -176.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -96.54 -1.19 47.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.132 -0.485 . . . . 1.02 111.447 -176.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 6.9 mt -127.78 142.32 44.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 110.409 -0.219 . . . . 0.77 110.409 -177.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 86.0 t60 -69.98 -56.8 6.04 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.657 -0.417 . . . . 1.85 110.029 175.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -143.07 104.09 4.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.119 -0.491 . . . . 0.78 110.533 179.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -92.15 133.27 35.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.15 0.5 . . . . 0.63 110.811 177.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 42.5 t -121.04 155.73 33.73 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.178 -0.675 . . . . 1.27 109.178 177.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -143.51 138.97 29.57 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.867 0.365 . . . . 0.64 110.585 -177.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -112.47 109.06 18.43 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.562 -0.533 . . . . 2.23 109.562 174.565 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.543 ' HA ' ' CG1' ' A' ' 59' ' ' ILE . 37.6 m -84.01 111.65 19.48 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.829 -0.623 . . . . 1.38 110.863 -174.256 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -132.05 157.69 43.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.091 0.472 . . . . 1.98 111.063 177.041 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.594 HG23 ' HD2' ' A' ' 64' ' ' PHE . 48.0 p -102.52 159.54 29.04 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.174 -0.467 . . . . 0.76 110.339 176.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . 0.536 ' HG2' HD22 ' A' ' 98' ' ' LEU . 18.3 Cg_endo -60.71 -37.26 80.28 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.582 2.188 . . . . 0.72 111.928 177.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.536 HD22 ' HG2' ' A' ' 97' ' ' PRO . 2.9 mm? -69.67 -32.64 71.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.109 -0.496 . . . . 2.08 110.362 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 76.6 tt0 -72.17 -50.8 24.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.086 0.47 . . . . 2.69 110.028 177.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -62.94 -35.21 79.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.762 -0.654 . . . . 1.46 111.607 -176.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -60.74 -33.0 72.26 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.873 0.368 . . . . 1.23 111.372 -178.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.639 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -78.18 -22.54 48.48 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.851 0.357 . . . . 2.66 110.638 177.729 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 91.2 mt . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 116.204 -0.453 . . . . 1.31 111.092 -178.704 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.2 tpp . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 110.034 -0.358 . . . . 36.14 110.034 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 165.46 -124.08 1.21 Allowed Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 111.622 -0.591 . . . . 33.7 111.622 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.3 m 62.63 25.77 15.31 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.643 0.377 . . . . 32.35 111.678 177.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.7 t -90.44 111.3 22.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.146 0.498 . . . . 30.38 110.914 -178.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -146.97 95.82 2.64 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.138 -0.69 . . . . 28.39 109.138 174.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -90.91 138.39 31.63 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.912 -0.585 . . . . 28.54 111.457 -172.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.5 p-80 -86.04 75.42 9.95 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.825 0.821 . . . . 26.47 110.329 175.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 74.0 t60 -72.95 122.39 21.61 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.87 -1.059 . . . . 24.34 109.835 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 39.0 m170 -72.42 -65.84 0.73 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.012 0.434 . . . . 23.8 110.888 -174.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -166.46 123.29 1.3 Allowed 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.742 -0.836 . . . . 20.9 108.742 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.3 m -53.49 -53.91 44.68 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 123.528 0.518 . . . . 19.89 112.374 -170.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.9 m 58.33 48.1 12.96 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.483 0.659 . . . . 17.26 109.537 -178.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -168.52 -29.38 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 CA-C-N 115.316 -0.856 . . . . 16.67 112.832 -176.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 47.3 mtp180 -97.12 -30.7 12.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.571 0.701 . . . . 19.13 109.324 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -87.72 19.76 3.3 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.929 -1.032 . . . . 14.57 111.005 -177.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -71.21 -1.86 14.02 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.14 -0.482 . . . . 15.4 111.691 -175.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.9 mp -82.16 -22.79 35.89 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.421 -0.354 . . . . 16.35 111.454 -178.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 40.0 m-85 -95.54 131.77 41.37 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.421 0.629 . . . . 15.41 112.061 -176.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -95.67 12.65 29.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.878 -1.055 . . . . 11.39 110.9 -178.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.407 ' O ' ' HG2' ' A' ' 27' ' ' LYS . 6.9 mt-30 -82.98 31.31 0.43 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.729 -0.668 . . . . 10.77 111.674 -175.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.33 0.11 89.37 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.983 -0.627 . . . . 6.73 111.995 176.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 61.1 t60 -79.26 131.33 36.13 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.822 -0.436 . . . . 6.08 109.822 177.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.2 mmt -61.79 122.24 14.89 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.481 0.658 . . . . 4.41 111.913 -174.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.9 t -161.01 168.15 25.06 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.759 -1.11 . . . . 1.71 108.378 -178.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.8 tp -56.7 -35.77 46.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 120.874 0.369 . . . . 1.37 110.855 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -65.91 -40.09 91.17 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.255 -0.429 . . . . 1.75 110.544 178.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.601 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -61.49 -40.91 96.26 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.787 -0.642 . . . . 2.5 110.447 -178.704 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 54.8 t -63.47 -55.38 23.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.9 -0.591 . . . . 1.04 110.857 -178.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.7 mp -58.22 -47.42 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.112 -0.494 . . . . 0.79 110.878 -179.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.18 -51.26 68.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.085 -0.507 . . . . 2.2 111.121 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -66.9 -34.51 77.94 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.479 -0.328 . . . . 1.67 111.33 -176.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.468 ' HB3' ' NZ ' ' A' ' 32' ' ' LYS . 10.1 mtpm? -63.5 -55.47 23.8 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 111.836 0.31 . . . . 2.03 111.836 -177.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.441 HD12 ' N ' ' A' ' 34' ' ' SER . 3.8 pp -70.46 -28.42 64.99 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.896 -0.322 . . . . 0.57 111.058 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.441 ' N ' HD12 ' A' ' 33' ' ' LEU . 19.6 t -65.37 -39.5 92.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.931 0.396 . . . . 1.29 110.558 178.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.1 m -67.83 -28.07 67.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.387 -0.37 . . . . 0.78 111.363 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.11 -54.96 3.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.309 -0.405 . . . . 0.64 111.961 -174.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.53 HD13 ' HZ ' ' A' ' 64' ' ' PHE . 65.9 mt -87.94 -16.72 33.04 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.707 0.289 . . . . 0.94 111.06 -175.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.5 mttp 49.55 76.39 0.55 Allowed Pre-proline 0 C--O 1.235 0.324 0 CA-C-N 115.348 -0.842 . . . . 3.36 112.635 178.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.479 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 51.5 Cg_endo -89.27 126.68 1.64 Allowed 'Trans proline' 0 N--CA 1.447 -1.259 0 C-N-CA 122.687 2.258 . . . . 0.63 111.769 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.3 p -63.16 -25.54 68.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.118 0.485 . . . . 0.73 110.966 177.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.693 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 89.3 t80 -141.76 141.62 33.23 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.617 -0.72 . . . . 0.76 109.491 175.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 45.7 tp -142.16 116.83 9.76 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.977 -0.379 . . . . 1.55 109.977 178.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.506 ' HB3' ' HB ' ' A' ' 58' ' ' VAL . 5.7 tp10 -105.47 130.05 53.63 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 110.036 -0.357 . . . . 2.23 110.036 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.9 mp -118.44 115.8 25.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.116 0.484 . . . . 1.72 110.82 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 44.1 t -122.13 144.04 32.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.861 -0.609 . . . . 1.08 110.108 179.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -72.67 115.01 11.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.134 0.492 . . . . 1.83 110.602 176.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.516 ' O ' ' HB2' ' A' ' 54' ' ' SER . 0.0 OUTLIER -131.64 78.88 1.85 Allowed 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 107.794 -1.187 . . . . 2.76 107.794 174.481 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.591 ' HA ' ' HB2' ' A' ' 54' ' ' SER . 50.3 m -66.32 129.79 41.03 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.179 -0.919 . . . . 3.2 111.052 -174.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 42.2 t -67.76 -22.45 65.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.739 -0.664 . . . . 4.74 110.58 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 139.39 -37.42 1.75 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.966 -0.635 . . . . 3.16 111.53 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.8 t -109.03 98.48 7.94 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.871 0.367 . . . . 4.36 110.033 177.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.75 178.49 50.44 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.989 -0.625 . . . . 2.26 112.801 177.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.2 m -67.57 139.19 56.9 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.263 0.554 . . . . 3.46 111.357 -179.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.591 ' HB2' ' HA ' ' A' ' 48' ' ' SER . 14.1 m -136.32 146.49 46.64 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.836 -0.801 . . . . 1.71 108.836 176.144 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -111.47 132.84 54.19 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.12 0.486 . . . . 1.15 110.774 -173.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.469 ' HB2' ' CB ' ' A' ' 47' ' ' LYS . 4.2 t70 -117.48 108.72 15.86 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.319 -0.993 . . . . 1.35 108.319 175.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.488 ' HA ' ' O ' ' A' ' 43' ' ' GLU . . . -111.15 124.91 53.13 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.14 0.495 . . . . 0.51 112.08 -171.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.506 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 58.6 t -90.02 116.74 31.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.641 -0.709 . . . . 0.55 109.421 174.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.66 HG12 ' HA ' ' A' ' 94' ' ' CYS . 2.5 pt -97.42 145.29 9.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 121.146 0.498 . . . . 1.18 110.77 -176.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.693 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 89.1 t -131.63 97.66 3.0 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 115.502 -0.772 . . . . 0.58 108.939 174.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.479 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 41.9 t -144.12 138.64 28.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.321 0.582 . . . . 0.84 112.1 -174.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.573 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 8.9 m-80 -67.66 -19.17 65.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.323 -0.853 . . . . 1.67 111.391 174.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -61.69 -22.35 65.25 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.364 0.602 . . . . 1.81 110.581 -178.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.647 ' CD2' ' HD2' ' A' ' 72' ' ' ARG . 13.5 m-85 -102.44 -5.91 23.55 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.943 -0.571 . . . . 3.19 112.156 -174.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.573 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -80.92 -10.09 59.76 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.946 0.403 . . . . 2.14 110.69 -176.85 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -75.79 -9.3 58.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.82 -0.627 . . . . 2.03 109.817 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.449 ' HA ' ' HD2' ' A' ' 67' ' ' LYS . 2.7 mmmp? 68.55 18.6 8.88 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.169 -0.923 . . . . 3.31 111.942 175.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.794 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 31.1 mmmt -69.5 89.79 0.52 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.347 -0.388 . . . . 1.99 109.995 174.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -63.77 -59.67 4.26 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.742 0.306 . . . . 2.33 110.476 -175.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.426 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.19 -31.18 71.4 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.188 -0.46 . . . . 1.09 111.31 -177.327 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.794 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 27.0 t70 -73.91 -43.95 56.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.498 -0.319 . . . . 2.08 110.788 -175.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.647 ' HD2' ' CD2' ' A' ' 64' ' ' PHE . 26.8 ptt180 -69.14 -31.93 70.94 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.297 -0.561 . . . . 2.93 109.76 177.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -65.03 -49.72 69.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.152 -0.477 . . . . 1.21 110.515 177.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.631 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 3.0 ptm180 -63.59 -40.93 98.21 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.52 -0.309 . . . . 1.67 110.767 -179.243 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.26 -50.34 68.33 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.631 0.253 . . . . 1.48 110.935 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 72' ' ' ARG . 49.2 t -56.58 -47.03 82.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.304 -0.407 . . . . 0.82 110.94 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -66.56 -29.93 70.12 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 121.097 -0.241 . . . . 1.14 111.619 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 85.4 m -67.61 -43.91 79.31 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.865 0.364 . . . . 0.69 111.307 -179.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.3 mp -81.29 -42.9 20.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 CA-C-O 121.331 0.586 . . . . 0.77 110.623 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.755 ' HA ' ' CB ' ' A' ' 83' ' ' GLU . 10.9 mp -73.27 -3.64 28.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.148 -0.478 . . . . 0.78 111.129 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 45.6 tptt -51.8 -63.29 1.18 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.534 -0.543 . . . . 1.93 109.534 169.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -75.16 -33.28 61.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.958 0.409 . . . . 2.91 110.346 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.755 ' CB ' ' HA ' ' A' ' 80' ' ' LEU . 1.9 tp10 -54.02 -56.23 19.93 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.751 0.786 . . . . 1.66 111.727 -176.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 57.5 mt -50.25 -30.95 12.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.243 -1.344 . . . . 0.58 112.882 177.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -54.76 -24.43 22.43 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.031 0.378 . . . . 0.92 111.608 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -102.6 -0.02 32.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.553 -0.294 . . . . 1.02 111.75 -176.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 8.3 mt -126.13 139.88 50.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.683 0.278 . . . . 0.77 110.383 -176.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 50.0 t60 -70.37 -42.19 72.11 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.804 -0.443 . . . . 1.85 109.804 175.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.418 ' O ' ' HB3' ' A' ' 54' ' ' SER . . . -157.54 111.6 2.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.159 -0.473 . . . . 0.78 110.629 177.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -103.11 121.87 43.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.387 -0.369 . . . . 0.63 110.504 176.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.3 m -111.33 147.32 35.37 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.754 -0.657 . . . . 1.27 109.494 177.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -135.82 142.17 44.81 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.013 0.435 . . . . 0.64 111.433 -178.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -109.49 112.98 25.39 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.291 -0.633 . . . . 2.23 109.291 173.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.66 ' HA ' HG12 ' A' ' 59' ' ' ILE . 5.7 p -83.54 116.22 22.47 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.923 -0.581 . . . . 1.38 111.224 -175.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -143.62 166.95 23.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.29 0.566 . . . . 1.98 111.372 176.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.527 HG21 ' HB3' ' A' ' 65' ' ' GLU . 22.0 p -113.87 163.32 19.07 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 115.544 -0.753 . . . . 0.76 110.901 -179.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.518 ' HG2' ' ND2' ' A' ' 62' ' ' ASN . 31.4 Cg_exo -60.95 -24.0 78.52 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.759 2.306 . . . . 0.72 111.899 177.396 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -66.44 -49.35 67.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.844 -0.616 . . . . 2.08 110.032 178.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.546 ' HA ' ' HD3' ' A' ' 102' ' ' LYS . 34.4 mt-10 -76.96 -30.44 56.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.071 -0.513 . . . . 2.69 110.682 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 52.0 t80 -66.88 -41.45 87.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.435 -0.348 . . . . 1.46 110.976 177.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -57.13 -38.14 73.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.027 0.442 . . . . 1.23 110.77 178.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.853 ' HA ' ' HE2' ' A' ' 106' ' ' LYS . 15.2 mtpp -58.07 -48.05 81.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.852 -0.613 . . . . 2.66 110.558 178.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 53.2 mt -66.89 -41.95 86.35 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.85 -0.614 . . . . 1.31 111.682 -175.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.48 ' HG3' ' N ' ' A' ' 105' ' ' SER . 7.0 pttp -83.09 -40.56 19.68 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.418 0.525 . . . . 1.84 112.418 -172.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.522 ' HB2' ' HD3' ' A' ' 106' ' ' LYS . 17.5 m -83.04 -50.17 8.8 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 111.95 0.352 . . . . 2.05 111.95 -172.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.853 ' HE2' ' HA ' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -117.76 -53.17 2.41 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.427 0.528 . . . . 4.02 112.427 -175.193 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 136.65 -41.94 1.36 Allowed Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.97 -0.633 . . . . 3.92 111.581 -176.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 51.3 m . . . . . 0 C--O 1.246 0.886 0 CA-C-O 118.58 -0.724 . . . . 4.98 110.211 178.767 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.1 ppp? . . . . . 0 N--CA 1.479 1.004 0 N-CA-C 110.171 -0.307 . . . . 36.14 110.171 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -112.6 -168.6 17.57 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.491 -0.861 . . . . 33.7 112.351 -178.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 42.3 m -84.86 -8.07 58.93 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.034 0.445 . . . . 32.35 110.525 178.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 24.4 m -77.85 114.04 16.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.979 -0.555 . . . . 30.38 110.198 177.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -97.12 165.69 11.94 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.07 -0.514 . . . . 28.39 111.303 -177.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 42.5 m80 -92.35 161.95 14.46 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.641 -0.709 . . . . 28.54 109.681 178.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 -121.57 97.84 5.69 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.012 0.434 . . . . 26.47 110.817 -177.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -86.86 109.75 19.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.061 -0.518 . . . . 24.34 110.25 175.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 58.3 m-70 -92.34 157.7 16.49 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.287 -0.415 . . . . 23.8 110.569 -177.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.7 t60 63.56 72.74 0.46 Allowed 'General case' 0 N--CA 1.464 0.225 0 O-C-N 123.716 0.635 . . . . 20.9 109.888 -175.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 35.8 t -154.11 111.26 3.4 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.666 -0.697 . . . . 19.89 109.586 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.7 p -94.3 89.0 5.75 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.975 0.417 . . . . 17.26 111.246 -176.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.611 ' HA2' ' HB3' ' A' ' 23' ' ' MET . . . 123.23 62.85 0.2 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.628 -0.796 . . . . 16.67 113.013 175.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 30.2 mtm180 -92.15 -44.07 9.01 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.511 -0.552 . . . . 19.13 109.511 177.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.416 ' HB2' ' CD1' ' A' ' 18' ' ' TYR . 1.4 pm0 -88.98 36.24 0.81 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.965 -0.562 . . . . 14.57 110.251 174.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.562 ' HA ' ' HA ' ' A' ' 22' ' ' HIS . 9.3 p30 -62.77 -8.96 7.75 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.728 -0.669 . . . . 15.4 111.59 -177.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.402 ' N ' HD22 ' A' ' 17' ' ' LEU . 2.9 mm? -71.3 -23.18 61.9 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.98 0.419 . . . . 16.35 110.242 178.31 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.416 ' CD1' ' HB2' ' A' ' 15' ' ' GLU . 5.6 m-85 -78.14 132.26 37.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.767 -0.651 . . . . 15.41 109.748 177.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.4 p90 -72.91 -28.15 62.3 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.101 0.477 . . . . 11.39 109.893 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -92.36 3.46 55.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.916 -0.584 . . . . 10.77 110.842 -179.563 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -151.74 47.9 0.56 Allowed Glycine 0 N--CA 1.444 -0.77 0 C-N-CA 120.748 -0.739 . . . . 6.73 111.836 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.562 ' HA ' ' HA ' ' A' ' 16' ' ' ASN . 6.0 t60 -69.57 -24.33 63.68 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.835 -0.802 . . . . 6.08 108.835 178.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.611 ' HB3' ' HA2' ' A' ' 13' ' ' GLY . 6.8 tpt 71.9 71.67 0.16 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-N 114.435 -1.257 . . . . 4.41 111.388 170.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.575 ' O ' HG23 ' A' ' 28' ' ' VAL . 21.3 t -76.48 135.65 39.36 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.39 -0.823 . . . . 1.71 109.591 173.614 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.0 tp -57.06 -38.65 61.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 O-C-N 123.242 0.339 . . . . 1.37 111.088 -176.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -61.68 -43.86 98.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.928 0.394 . . . . 1.75 110.279 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -71.27 -26.3 62.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.122 -0.49 . . . . 2.5 111.01 -177.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.575 HG23 ' O ' ' A' ' 24' ' ' CYS . 91.2 t -61.76 -53.86 42.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.367 -0.379 . . . . 1.04 110.19 176.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.482 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.8 mp -61.17 -43.76 97.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.784 -0.644 . . . . 0.79 110.228 178.424 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -52.67 -51.81 58.56 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 116.028 -0.533 . . . . 2.2 111.769 178.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -69.69 -30.93 68.7 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.283 0.563 . . . . 1.67 110.684 -177.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 31.1 tttm -68.57 -54.48 16.35 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.378 -0.828 . . . . 2.03 111.065 -176.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 3.9 pp -71.92 -27.04 62.55 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 120.757 -0.377 . . . . 0.57 111.048 176.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.466 ' N ' HD12 ' A' ' 33' ' ' LEU . 44.3 t -61.93 -44.04 97.6 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-O 120.805 0.336 . . . . 1.29 110.226 176.301 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.2 m -64.22 -27.37 69.01 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.327 -0.397 . . . . 0.78 110.965 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.86 -54.43 5.6 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.093 0.405 . . . . 0.64 112.093 -177.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.0 mt -97.07 -35.59 10.77 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.867 0.365 . . . . 0.94 111.725 -174.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.49 ' HD3' ' HA ' ' A' ' 38' ' ' LYS . 31.8 mmtt 58.15 87.29 0.14 Allowed Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.364 -0.835 . . . . 3.36 112.862 -177.631 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.817 ' HB3' HG12 ' A' ' 59' ' ' ILE . 73.7 Cg_endo -82.91 137.62 8.77 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 122.62 2.213 . . . . 0.63 111.34 171.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 33.4 p -77.54 -23.89 50.01 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.42 0.629 . . . . 0.73 109.695 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.623 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 83.9 t80 -136.3 124.05 22.5 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.123 -0.944 . . . . 0.76 109.176 172.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.419 HD12 ' O ' ' A' ' 58' ' ' VAL . 56.7 tp -134.9 113.86 11.97 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.432 -0.349 . . . . 1.55 110.337 -177.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -120.37 124.85 46.54 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.385 -0.371 . . . . 2.23 110.974 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 67.1 mt -86.4 122.16 29.97 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.172 0.511 . . . . 1.72 110.787 175.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 67.6 t -106.96 111.09 34.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.479 -0.782 . . . . 1.08 109.05 175.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -69.28 102.11 1.65 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.994 -0.548 . . . . 1.83 109.977 -177.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 36.2 mmtm -76.66 167.0 22.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.046 -0.525 . . . . 2.76 111.05 -177.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.3 p -63.05 130.21 43.68 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.935 -0.575 . . . . 3.2 110.386 176.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.7 p -62.2 -67.55 0.41 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.091 -0.504 . . . . 4.74 111.466 -178.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 68.31 -82.32 0.19 Allowed Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 121.031 -0.604 . . . . 3.16 112.51 179.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 10.8 p -94.74 -19.1 20.66 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.83 0.347 . . . . 4.36 111.002 -179.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 168.29 -176.09 42.82 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.81 -0.709 . . . . 2.26 111.996 179.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.446 ' O ' ' HB3' ' A' ' 88' ' ' HIS . 19.9 m -58.65 115.34 2.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.865 0.364 . . . . 3.46 111.299 -179.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.3 m -127.12 120.79 29.7 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.867 -0.606 . . . . 1.71 110.993 -176.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -111.43 138.69 47.61 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.091 -0.504 . . . . 1.15 110.384 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -116.54 123.02 46.38 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.24 -0.652 . . . . 1.35 109.24 176.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.98 115.74 30.74 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.863 0.363 . . . . 0.51 110.899 -176.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.789 HG22 ' HE2' ' A' ' 93' ' ' LYS . 38.3 t -81.07 110.95 17.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 108.621 -0.881 . . . . 0.55 108.621 173.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.817 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -111.53 107.7 23.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 CA-C-O 121.679 0.752 . . . . 1.18 110.485 -174.011 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.623 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 58.0 t -104.58 106.64 20.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 CA-C-N 114.94 -1.027 . . . . 0.58 108.464 174.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.589 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 32.7 t -142.84 147.43 35.41 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.755 0.65 . . . . 0.84 112.755 -170.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.473 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 0.6 OUTLIER -64.09 -22.19 66.83 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 114.988 -1.006 . . . . 1.67 110.829 173.258 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -63.35 -35.62 81.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.188 0.518 . . . . 1.81 110.417 -177.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.415 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 27.2 t80 -100.49 12.04 38.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.318 0.58 . . . . 3.19 110.118 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.473 ' HB3' ' O ' ' A' ' 62' ' ' ASN . 2.2 tp10 -81.31 -28.55 34.55 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 108.087 -1.079 . . . . 2.14 108.087 176.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.599 ' OD2' ' HG3' ' A' ' 68' ' ' LYS . 21.0 t70 -57.32 -41.13 79.33 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 108.293 -1.003 . . . . 2.03 108.293 166.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.0 ttpm? 75.59 25.02 1.25 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 114.476 -1.238 . . . . 3.31 113.161 161.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.599 ' HG3' ' OD2' ' A' ' 66' ' ' ASP . 36.7 mtmm -74.76 122.53 23.44 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 121.97 -0.456 . . . . 1.99 109.959 169.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.5 pp -74.0 -32.18 63.28 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.772 -0.371 . . . . 2.33 110.953 -175.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.504 HD13 ' HB3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -67.72 -30.81 70.4 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.038 0.447 . . . . 1.09 110.417 177.32 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.469 ' HB2' ' HE2' ' A' ' 68' ' ' LYS . 36.0 t70 -72.62 -36.91 68.16 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.155 0.502 . . . . 2.08 109.658 179.49 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.415 ' HB2' ' CE1' ' A' ' 64' ' ' PHE . 48.3 ttt-85 -57.77 -47.25 83.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.496 -0.775 . . . . 2.93 109.563 172.309 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -57.22 -54.46 46.5 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.143 -0.935 . . . . 1.21 111.28 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.428 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 13.2 ptm180 -70.7 -46.42 63.15 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.285 0.476 . . . . 1.67 112.285 -172.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 75' ' ' LEU . 27.3 mt -63.08 -45.97 89.63 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 111.759 0.281 . . . . 1.48 111.759 -176.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.536 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 58.7 t -58.05 -48.25 84.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.57 -0.286 . . . . 0.82 110.487 179.002 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -66.58 -31.7 72.57 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.687 -0.405 . . . . 1.14 111.564 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 99.2 m -61.71 -61.41 2.53 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.655 0.242 . . . . 0.69 111.655 -178.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.5 mp -75.95 -43.8 38.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-O 121.071 0.463 . . . . 0.77 110.833 -176.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.802 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.4 mp -77.65 -7.55 56.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.903 -0.59 . . . . 0.78 112.338 -171.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -50.13 -62.55 1.51 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.277 0.56 . . . . 1.93 109.9 171.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -75.15 -33.52 61.53 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.448 -0.796 . . . . 2.91 110.708 177.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.802 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.3 tp10 -56.29 -53.53 56.21 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.477 0.656 . . . . 1.66 112.026 -176.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.672 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 66.3 mt -50.72 -30.44 13.88 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.711 -1.131 . . . . 0.58 112.505 179.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -53.5 -27.36 25.07 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.046 0.451 . . . . 0.92 111.038 -178.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -87.0 -6.78 58.64 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.804 -0.634 . . . . 1.02 111.701 -175.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.476 HD12 ' HB2' ' A' ' 90' ' ' PHE . 3.2 mt -125.52 160.36 31.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 109.969 -0.382 . . . . 0.77 109.969 -176.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.446 ' HB3' ' O ' ' A' ' 53' ' ' THR . 10.5 t60 -79.36 -54.82 5.56 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.421 -0.585 . . . . 1.85 109.421 174.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -145.26 115.59 7.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.828 -0.624 . . . . 0.78 110.176 177.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . 0.476 ' HB2' HD12 ' A' ' 87' ' ' ILE . 86.2 t80 -108.4 129.19 55.26 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.161 0.505 . . . . 0.63 110.605 177.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 38.2 t -115.02 146.76 40.93 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.267 -0.879 . . . . 1.27 109.25 177.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -129.3 130.69 46.48 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.929 0.395 . . . . 0.64 110.417 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.789 ' HE2' HG22 ' A' ' 58' ' ' VAL . 2.3 ttmm -113.7 109.01 17.9 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.864 -0.791 . . . . 2.23 108.864 176.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.514 ' HA ' HG23 ' A' ' 59' ' ' ILE . 13.2 p -92.16 140.9 29.17 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.934 0.397 . . . . 1.38 111.358 -172.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.617 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 8.7 t60 -153.65 154.43 34.16 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.939 -0.573 . . . . 1.98 109.712 177.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.407 ' CG2' ' HA ' ' A' ' 65' ' ' GLU . 1.3 p -96.6 148.79 34.97 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 121.042 0.449 . . . . 0.76 112.093 -177.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -67.87 -35.34 21.31 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 123.255 2.637 . . . . 0.72 113.075 -176.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' A' ' 98' ' ' LEU . 4.4 mm? -59.4 -48.22 82.46 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.112 0.482 . . . . 2.08 110.225 179.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -66.24 -33.78 76.52 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.623 -0.717 . . . . 2.69 111.012 177.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 49.7 t80 -69.83 -33.99 73.07 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.469 -0.332 . . . . 1.46 111.4 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -58.08 -35.15 70.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.94 0.4 . . . . 1.23 111.087 -178.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.704 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -74.91 -29.35 60.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.907 0.384 . . . . 2.66 110.378 178.528 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.772 ' HA ' ' HA2' ' A' ' 107' ' ' GLY . 89.7 mt -67.84 -47.09 69.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.941 -0.572 . . . . 1.31 110.67 179.19 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.88 -15.78 61.59 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.205 -0.452 . . . . 1.84 111.147 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 28.4 t -80.95 -39.62 25.81 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.766 -0.457 . . . . 2.05 109.766 176.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.28 -41.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.821 -0.627 . . . . 4.02 110.74 179.103 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.772 ' HA2' ' HA ' ' A' ' 103' ' ' LEU . . . 117.18 27.17 2.75 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.419 -0.809 . . . . 3.92 111.684 -179.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.5 t . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.27 -0.871 . . . . 4.98 109.455 -178.311 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.1 ptt? . . . . . 0 N--CA 1.479 0.988 0 N-CA-C 109.919 -0.4 . . . . 36.14 109.919 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 110.87 25.49 5.1 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.362 -0.923 . . . . 33.7 112.532 177.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.3 m -101.6 -4.28 26.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.23 0.538 . . . . 32.35 110.01 178.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.2 m -110.32 147.16 34.44 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.4 -0.818 . . . . 30.38 109.974 -177.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 4.8 p-80 -93.05 87.14 5.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.517 0.675 . . . . 28.39 111.442 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 85.6 m-70 -109.6 13.31 23.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.877 -0.602 . . . . 28.54 110.275 175.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -162.45 143.58 10.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.168 -0.469 . . . . 26.47 110.343 -178.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 50.6 t-80 -92.95 147.62 22.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.143 -0.48 . . . . 24.34 109.756 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 40.2 m-70 -82.78 -174.42 5.23 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.927 0.394 . . . . 23.8 111.014 178.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.9 m-70 -97.04 129.43 44.48 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.081 -0.509 . . . . 20.9 111.523 -176.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.41 ' HB2' ' H ' ' A' ' 12' ' ' SER . 3.5 p -88.22 -146.53 0.15 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.564 -0.744 . . . . 19.89 110.194 175.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.41 ' H ' ' HB2' ' A' ' 11' ' ' SER . 11.6 t -61.53 129.2 40.0 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.854 -0.424 . . . . 17.26 109.854 177.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 128.85 -0.51 6.2 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 121.16 -0.543 . . . . 16.67 111.75 -176.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.1 ptt180 -93.89 -26.6 16.81 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.365 0.603 . . . . 19.13 109.843 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.416 ' H ' ' CD ' ' A' ' 15' ' ' GLU . 1.2 pm0 -87.65 16.87 5.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.412 -0.813 . . . . 14.57 111.198 -176.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -69.15 -9.06 50.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.063 0.459 . . . . 15.4 110.407 178.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 87.9 mt -68.94 -20.19 64.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.858 -0.61 . . . . 16.35 110.47 177.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 -104.73 142.92 33.85 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.982 -0.554 . . . . 15.41 109.748 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 48.2 p90 -59.56 -39.05 82.78 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.703 0.287 . . . . 11.39 111.441 -176.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.411 ' H ' ' HG3' ' A' ' 20' ' ' GLN . 0.9 OUTLIER -89.0 8.08 31.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.85 0.357 . . . . 10.77 111.273 -179.607 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -94.59 -9.39 58.87 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.78 -0.724 . . . . 6.73 112.19 -177.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -148.58 113.53 5.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.22 0.534 . . . . 6.08 110.112 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 75.8 mtm -130.46 145.22 51.8 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.19 -0.459 . . . . 4.41 110.06 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 32.3 m -65.83 146.11 55.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.033 -0.531 . . . . 1.71 110.74 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.3 tp -57.2 -34.04 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-O 121.178 0.513 . . . . 1.37 110.925 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.422 HE21 ' HB2' ' A' ' 44' ' ' LEU . 60.9 tt0 -65.52 -38.89 91.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.104 -0.498 . . . . 1.75 110.922 178.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.718 ' HA ' ' HE3' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -68.4 -46.57 69.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.093 -0.503 . . . . 2.5 111.193 -175.615 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.533 ' O ' ' HG2' ' A' ' 32' ' ' LYS . 5.3 p -64.87 -46.04 93.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 C-N-CA 120.833 -0.347 . . . . 1.04 111.163 -177.445 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.47 HD12 HG13 ' A' ' 28' ' ' VAL . 1.7 mp -60.71 -47.62 92.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-O 121.033 0.444 . . . . 0.79 110.721 178.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.64 -42.02 91.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.326 -0.397 . . . . 2.2 110.77 -178.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -68.04 -35.4 78.2 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.167 -0.47 . . . . 1.67 111.423 -175.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 28' ' ' VAL . 74.1 mmtt -65.06 -55.61 17.84 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.935 0.398 . . . . 2.03 111.067 -178.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.497 HD12 ' N ' ' A' ' 34' ' ' SER . 3.3 pp -71.81 -28.9 63.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.126 -0.488 . . . . 0.57 112.135 -174.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.497 ' N ' HD12 ' A' ' 33' ' ' LEU . 69.7 m -69.23 -43.05 74.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.769 0.319 . . . . 1.29 110.97 179.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.7 m -71.3 -27.45 63.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.1 0.476 . . . . 0.78 111.076 -178.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.65 -54.94 4.0 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.032 0.382 . . . . 0.64 112.032 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.1 mt -81.85 -32.04 31.33 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.848 0.314 . . . . 0.94 111.848 -173.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm 65.16 74.77 0.38 Allowed Pre-proline 0 N--CA 1.468 0.456 0 O-C-N 123.595 0.559 . . . . 3.36 110.99 -175.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.6 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 63.0 Cg_endo -88.66 134.76 2.83 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 122.289 1.993 . . . . 0.63 112.374 176.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 30.4 p -68.86 -30.56 69.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.276 0.56 . . . . 0.73 109.64 175.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.677 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 86.3 t80 -141.91 134.27 27.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.325 -0.852 . . . . 0.76 109.262 174.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.414 HD22 ' HA ' ' A' ' 42' ' ' LEU . 1.4 tm? -142.24 126.16 17.19 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.547 -0.538 . . . . 1.55 109.547 -178.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -137.48 127.79 26.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.889 0.375 . . . . 2.23 110.934 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.422 ' HB2' HE21 ' A' ' 26' ' ' GLN . 2.5 mm? -90.61 115.76 27.98 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.368 -0.604 . . . . 1.72 109.368 177.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 52.5 t -109.08 118.25 56.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.901 0.382 . . . . 1.08 110.769 -178.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -91.19 123.64 34.79 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.108 -0.701 . . . . 1.83 109.108 173.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 60.6 tttp -136.38 89.46 2.47 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.791 0.329 . . . . 2.76 110.857 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 44.6 m 54.45 62.46 2.55 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.454 -0.794 . . . . 3.2 112.164 174.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 3.5 p -75.63 111.22 10.72 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.132 -0.485 . . . . 4.74 109.905 176.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -78.42 -45.97 9.34 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.962 -0.637 . . . . 3.16 113.188 -174.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 45.8 m -108.18 102.32 11.48 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.786 0.327 . . . . 4.36 111.4 -176.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 70.13 -94.6 0.46 Allowed Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.941 -0.572 . . . . 2.26 112.342 177.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.8 t -152.66 135.83 15.72 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.219 0.533 . . . . 3.46 110.488 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 62.3 m -146.52 119.62 8.84 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.315 -0.857 . . . . 1.71 109.109 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -111.39 137.6 48.96 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.597 -0.274 . . . . 1.15 110.82 -176.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -102.18 110.23 22.13 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.754 -1.202 . . . . 1.35 107.754 168.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.77 117.53 34.25 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 120.899 0.38 . . . . 0.51 111.268 -171.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.7 t -73.39 111.27 7.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 109.026 -0.731 . . . . 0.55 109.026 176.285 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -106.87 107.81 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 CA-C-O 121.774 0.797 . . . . 1.18 109.571 -178.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.677 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 58.7 t -108.21 103.97 16.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.108 -0.951 . . . . 0.58 108.971 177.087 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.6 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 29.0 t -145.26 153.27 41.13 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.986 0.422 . . . . 0.84 111.291 -175.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.743 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 22.9 m120 -67.44 -19.21 65.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.486 -0.779 . . . . 1.67 110.477 175.083 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -63.65 -18.97 64.5 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.236 0.541 . . . . 1.81 110.384 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.612 ' HD2' HG23 ' A' ' 96' ' ' THR . 62.9 t80 -93.46 -19.8 20.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 3.19 111.561 -178.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.743 ' HG2' ' O ' ' A' ' 62' ' ' ASN . 11.9 pt-20 -71.23 -20.06 62.29 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.627 -0.429 . . . . 2.14 110.474 -176.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.633 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . 17.2 m-20 -69.15 -20.48 64.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.029 -0.532 . . . . 2.03 110.581 175.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.402 ' HD3' ' HA ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER 64.11 19.74 11.89 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.453 -0.794 . . . . 3.31 110.777 177.222 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.633 ' HG2' ' HB3' ' A' ' 66' ' ' ASP . 31.3 mmmt -79.54 102.63 8.95 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.907 -0.588 . . . . 1.99 110.323 -178.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.411 HD12 ' N ' ' A' ' 70' ' ' LEU . 3.7 pp -67.55 -44.22 78.8 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.324 -0.398 . . . . 2.33 110.767 -177.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.431 ' CD1' ' H ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -67.73 -31.24 71.04 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.49 -0.323 . . . . 1.09 111.254 -178.972 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.703 ' HA ' ' HD2' ' A' ' 74' ' ' ARG . 4.8 m-20 -73.55 -44.77 56.68 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 121.094 -0.242 . . . . 2.08 111.345 -178.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 18.3 ptt180 -67.89 -31.93 72.07 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.909 -0.716 . . . . 2.93 109.82 176.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -64.03 -50.97 66.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.071 -0.513 . . . . 1.21 110.521 176.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.703 ' HD2' ' HA ' ' A' ' 71' ' ' ASP . 5.0 ptm180 -63.57 -39.55 94.68 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.399 -0.364 . . . . 1.67 110.836 -177.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -66.48 -51.84 52.48 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.723 0.297 . . . . 1.48 111.046 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.705 HG13 HD22 ' A' ' 80' ' ' LEU . 45.6 t -57.74 -45.69 86.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.065 -0.516 . . . . 0.82 110.978 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.555 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 12.7 m120 -62.73 -42.01 99.45 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.475 -0.49 . . . . 1.14 111.262 -178.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.467 ' HB ' HD12 ' A' ' 79' ' ' ILE . 89.3 m -58.76 -54.67 44.44 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.113 0.412 . . . . 0.69 112.113 -175.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.467 HD12 ' HB ' ' A' ' 78' ' ' THR . 4.3 mp -88.01 -48.51 15.04 Favored 'Isoleucine or valine' 0 C--O 1.242 0.663 0 CA-C-O 121.643 0.735 . . . . 0.77 111.016 -175.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.79 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 7.7 mp -73.31 -4.37 32.82 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.654 -0.703 . . . . 0.78 111.668 -173.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.555 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 17.6 tppt? -55.72 -60.0 4.07 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.358 -0.608 . . . . 1.93 109.358 168.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.453 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 6.9 mm-40 -67.72 -32.94 73.91 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.65 -0.705 . . . . 2.91 110.261 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.642 ' CB ' ' HA ' ' A' ' 80' ' ' LEU . 2.6 tp10 -54.59 -55.35 30.35 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.815 -0.63 . . . . 1.66 111.054 176.187 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.79 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 56.3 mt -51.03 -30.58 15.88 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.273 -0.876 . . . . 0.58 112.46 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.453 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 23.1 mm-40 -54.41 -25.52 25.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.64 0.257 . . . . 0.92 111.436 -176.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -106.63 8.28 31.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.716 0.293 . . . . 1.02 111.326 -177.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 11.2 mt -129.35 155.81 41.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 109.635 -0.506 . . . . 0.77 109.635 -178.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -86.9 -61.11 1.8 Allowed 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.414 -0.514 . . . . 1.85 109.778 175.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -137.85 95.15 2.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.056 0.455 . . . . 0.78 110.99 178.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -84.68 119.63 25.47 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.018 -0.537 . . . . 0.63 110.204 176.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 38.0 m -112.42 157.13 21.43 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.556 -0.535 . . . . 1.27 109.556 177.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -134.97 137.78 43.38 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.96 0.409 . . . . 0.64 110.655 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -103.12 109.0 20.41 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.338 -0.986 . . . . 2.23 108.338 176.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 25.7 m -88.08 127.84 35.41 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 111.837 0.31 . . . . 1.38 111.837 -169.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.617 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 73.0 m-70 -148.42 160.95 42.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.108 0.48 . . . . 1.98 110.668 174.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.612 HG23 ' HD2' ' A' ' 64' ' ' PHE . 22.6 p -108.44 159.42 30.87 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.771 -0.65 . . . . 0.76 110.697 176.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -59.26 -26.35 81.5 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.594 2.196 . . . . 0.72 111.834 176.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -62.9 -49.78 73.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.012 -0.54 . . . . 2.08 109.961 176.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.481 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 30.5 mt-10 -60.4 -47.71 84.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.873 -0.603 . . . . 2.69 110.313 176.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.578 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 51.4 t80 -60.43 -39.16 86.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.617 -0.72 . . . . 1.46 111.087 -177.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.527 ' HA ' ' HE2' ' A' ' 104' ' ' LYS . 18.8 t70 -60.78 -37.68 82.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.954 0.407 . . . . 1.23 110.772 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.538 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.3 OUTLIER -71.92 -32.35 67.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.138 -0.483 . . . . 2.66 110.362 178.6 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 85.7 mt -64.43 -41.6 96.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.071 -0.513 . . . . 1.31 110.83 177.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.578 ' HG3' ' O ' ' A' ' 100' ' ' TYR . 12.2 mtmt -63.98 -43.13 96.64 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.501 0.667 . . . . 1.84 109.704 176.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 48.4 m -69.54 -71.3 0.23 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.81 -1.086 . . . . 2.05 111.722 -173.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.445 ' HG3' ' O ' ' A' ' 102' ' ' LYS . 5.8 pttt -99.56 -36.55 9.49 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.739 0.305 . . . . 4.02 111.348 -176.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 109.02 12.92 19.35 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.68 -0.771 . . . . 3.92 112.011 -178.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.458 ' OXT' ' HB3' ' A' ' 102' ' ' LYS . 34.1 m . . . . . 0 C--O 1.249 1.075 0 N-CA-C 108.969 -0.752 . . . . 4.98 108.969 179.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.1 mtm . . . . . 0 N--CA 1.48 1.05 0 N-CA-C 109.389 -0.597 . . . . 36.14 109.389 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -101.94 110.58 3.85 Favored Glycine 0 N--CA 1.441 -0.971 0 N-CA-C 110.573 -1.011 . . . . 33.7 110.573 171.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 56.1 m -52.59 110.53 0.52 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.984 0.421 . . . . 32.35 110.847 -177.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.8 m -78.93 116.04 19.0 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.887 -0.597 . . . . 30.38 110.344 -177.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -106.48 174.05 6.06 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.823 -0.626 . . . . 28.39 110.459 -177.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 14.3 m170 -100.96 144.95 29.28 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 110.223 -0.288 . . . . 28.54 110.223 -174.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.0 m170 -95.39 151.9 18.87 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.557 -0.534 . . . . 26.47 109.557 175.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 27.6 t60 -71.94 124.97 26.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.002 0.43 . . . . 24.34 110.779 -173.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -111.63 172.22 7.02 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.914 -0.584 . . . . 23.8 109.662 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 43.5 p-80 -90.7 119.8 31.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.271 0.557 . . . . 20.9 110.16 177.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 25.1 m -92.36 161.37 14.7 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.756 -0.656 . . . . 19.89 110.022 178.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.7 m -87.1 9.09 20.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.484 0.659 . . . . 17.26 111.146 -176.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -85.62 12.23 59.68 Favored Glycine 0 C--O 1.224 -0.495 0 CA-C-N 115.366 -0.834 . . . . 16.67 111.335 177.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.495 ' HG3' ' HG2' ' A' ' 15' ' ' GLU . 4.4 ptm85 -72.77 -36.19 67.59 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 122.943 0.497 . . . . 19.13 111.506 -179.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.51 ' HB2' ' CE2' ' A' ' 18' ' ' TYR . 5.9 pt-20 -119.48 61.55 0.82 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.78 0.8 . . . . 14.57 111.183 -174.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -88.92 3.8 50.16 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.783 -1.099 . . . . 15.4 110.338 177.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.7 mt -75.11 -32.24 61.34 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.741 -0.663 . . . . 16.35 111.872 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.66 ' HB3' ' HA3' ' A' ' 21' ' ' GLY . 8.3 m-85 -80.94 88.27 5.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.72 0.295 . . . . 15.41 110.469 -176.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -83.51 -12.99 55.57 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.978 0.418 . . . . 11.39 110.774 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -131.15 12.78 5.14 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.551 0.691 . . . . 10.77 109.591 174.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.66 ' HA3' ' HB3' ' A' ' 18' ' ' TYR . . . -93.59 -46.77 3.13 Favored Glycine 0 N--CA 1.449 -0.499 0 CA-C-N 115.419 -0.809 . . . . 6.73 113.942 -171.156 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -129.47 17.86 5.88 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 117.37 0.585 . . . . 6.08 111.531 -174.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 66.4 mtm -117.9 157.15 27.2 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.742 -0.466 . . . . 4.41 109.742 177.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 84.5 m -60.63 108.13 0.79 Allowed 'General case' 0 C--N 1.329 -0.31 0 O-C-N 123.216 0.322 . . . . 1.71 110.884 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 10.1 tp -59.48 -30.06 43.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.931 -0.577 . . . . 1.37 110.948 -178.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -60.31 -43.41 96.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.198 -0.455 . . . . 1.75 110.437 177.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.543 ' HE3' ' HB2' ' A' ' 31' ' ' ASP . 38.8 tptt -67.5 -36.92 82.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.956 -0.565 . . . . 2.5 110.843 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 61.3 t -57.91 -52.24 60.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.061 0.457 . . . . 1.04 110.589 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.475 HG13 ' HG3' ' A' ' 83' ' ' GLU . 1.8 mp -64.35 -47.34 90.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.808 -0.633 . . . . 0.79 110.542 178.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -54.81 -52.05 63.9 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 116.218 -0.446 . . . . 2.2 110.892 -179.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.543 ' HB2' ' HE3' ' A' ' 27' ' ' LYS . 10.6 t70 -66.07 -31.09 71.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.245 -0.434 . . . . 1.67 110.971 -174.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 52.3 tptt -70.15 -55.63 8.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.517 -0.31 . . . . 2.03 111.258 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.511 HD12 ' N ' ' A' ' 34' ' ' SER . 3.9 pp -71.47 -26.32 62.66 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.894 -0.322 . . . . 0.57 111.168 -178.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.511 ' N ' HD12 ' A' ' 33' ' ' LEU . 9.5 t -66.77 -42.24 86.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.94 0.4 . . . . 1.29 110.132 178.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 26.3 m -71.59 -27.07 62.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.12 0.486 . . . . 0.78 111.027 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.79 -52.2 7.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.121 -0.49 . . . . 0.64 111.615 -178.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.2 mt -83.65 -42.09 17.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.504 -0.316 . . . . 0.94 111.23 -176.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 56.92 83.94 0.22 Allowed Pre-proline 0 N--CA 1.464 0.227 0 CA-C-O 121.694 0.759 . . . . 3.36 111.436 -175.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.618 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 74.2 Cg_endo -92.24 151.47 3.11 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 123.271 2.647 . . . . 0.63 112.991 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.7 p -76.95 -27.24 54.75 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.419 0.628 . . . . 0.73 109.958 175.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.776 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 88.6 t80 -141.73 132.52 25.74 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.336 -0.847 . . . . 0.76 109.082 173.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.55 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 60.0 tp -142.38 121.42 12.89 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 110.317 -0.253 . . . . 1.55 110.317 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -124.4 115.83 21.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.065 0.46 . . . . 2.23 110.78 178.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -85.94 115.5 23.6 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.135 -0.691 . . . . 1.72 109.135 174.047 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.593 HG12 ' HG3' ' A' ' 47' ' ' LYS . 19.8 t -106.13 113.56 43.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 120.913 0.387 . . . . 1.08 110.711 -177.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -72.66 106.08 4.53 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.937 -0.574 . . . . 1.83 110.042 175.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.593 ' HG3' HG12 ' A' ' 45' ' ' VAL . 56.4 mtmt -133.05 98.12 4.19 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.816 -0.629 . . . . 2.76 109.706 177.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 34.0 t -64.51 110.71 2.4 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.303 0.573 . . . . 3.2 110.541 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 22.9 t -79.21 -11.18 59.96 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.47 -0.787 . . . . 4.74 110.182 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 156.34 -58.25 0.37 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 121.033 -0.603 . . . . 3.16 112.53 179.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 6.4 p -71.46 -32.32 68.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.87 0.367 . . . . 4.36 111.575 -177.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 114.85 -44.52 1.47 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.827 -0.701 . . . . 2.26 111.734 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.9 p -82.45 64.2 6.98 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.547 0.689 . . . . 3.46 110.903 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.426 ' HA ' ' O ' ' A' ' 89' ' ' ALA . 25.0 p -136.44 117.3 14.14 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.422 -0.808 . . . . 1.71 110.384 -179.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -124.96 137.69 54.25 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.176 -0.466 . . . . 1.15 110.442 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -114.68 122.04 45.23 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.831 -0.622 . . . . 1.35 109.519 178.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -107.11 115.99 31.14 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.911 0.386 . . . . 0.51 111.861 -174.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.2 t -83.25 111.76 19.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.19 -0.67 . . . . 0.55 109.19 173.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -111.97 115.09 48.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.646 0.736 . . . . 1.18 110.594 -174.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.776 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 74.7 t -114.49 106.83 21.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.013 -0.994 . . . . 0.58 109.411 176.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.618 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 42.5 t -146.7 153.01 39.76 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.87 0.692 . . . . 0.84 112.87 -173.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.46 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 12.4 m120 -67.31 -22.0 65.64 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.109 -0.95 . . . . 1.67 110.518 172.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -65.57 -24.04 66.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.293 0.568 . . . . 1.81 110.13 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.445 ' CE1' ' HD3' ' A' ' 72' ' ' ARG . 71.0 t80 -103.06 -2.93 26.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.683 -0.69 . . . . 3.19 110.449 178.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.477 ' HA ' HG21 ' A' ' 96' ' ' THR . 0.9 OUTLIER -72.49 -33.18 66.77 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.584 -0.525 . . . . 2.14 109.584 -175.157 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.653 ' OD2' ' HD3' ' A' ' 68' ' ' LYS . 3.1 t70 -63.6 -14.41 51.29 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.716 -0.476 . . . . 2.03 109.716 176.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 30.6 mtmm 63.25 50.08 3.09 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.159 -0.928 . . . . 3.31 111.458 174.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.653 ' HD3' ' OD2' ' A' ' 66' ' ' ASP . 30.5 mmmt -89.37 96.09 10.56 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.091 -0.959 . . . . 1.99 110.527 179.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 46.9 tp -55.69 -64.31 0.89 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.018 -0.537 . . . . 2.33 111.741 -178.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.419 ' CD1' ' H ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -65.92 -31.01 71.69 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.211 -0.449 . . . . 1.09 111.46 -175.143 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.579 ' HB2' ' HB3' ' A' ' 68' ' ' LYS . 23.3 m-20 -73.59 -36.42 65.54 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.844 0.313 . . . . 2.08 111.844 -176.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.445 ' HD3' ' CE1' ' A' ' 64' ' ' PHE . 25.0 ptt85 -69.9 -32.93 71.52 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 119.891 -0.724 . . . . 2.93 109.393 175.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -64.73 -49.36 71.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.693 -0.685 . . . . 1.21 110.231 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.525 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 4.2 ptm180 -69.57 -40.51 76.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.864 -0.607 . . . . 1.67 111.508 -178.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 35.9 tp -64.96 -47.2 78.46 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.732 0.301 . . . . 1.48 110.743 -177.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.636 HG13 HD22 ' A' ' 80' ' ' LEU . 37.2 t -57.31 -48.32 82.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.98 -0.554 . . . . 0.82 110.701 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -61.19 -33.58 73.69 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.652 -0.249 . . . . 1.14 111.533 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 95.9 m -63.62 -56.16 17.97 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 111.804 0.298 . . . . 0.69 111.804 -178.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.2 mp -76.78 -46.84 29.62 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 CA-C-O 121.317 0.58 . . . . 0.77 110.744 -178.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.948 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 9.1 mp -73.16 -3.6 27.57 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.879 -0.6 . . . . 0.78 111.589 -175.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 48.0 tptt -50.64 -63.69 1.04 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.635 -0.506 . . . . 1.93 109.635 170.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -75.07 -36.49 61.77 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.417 -0.356 . . . . 2.91 110.622 177.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.948 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 34.4 tt0 -57.09 -45.32 83.45 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.349 -0.387 . . . . 1.66 111.895 -176.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 42.4 mt -56.81 -30.78 64.05 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.471 0.545 . . . . 0.58 112.471 -177.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -54.93 -24.57 24.3 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 120.857 0.36 . . . . 0.92 111.5 -174.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -91.44 -4.78 55.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.247 -0.433 . . . . 1.02 111.129 -175.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.444 HD11 HG12 ' A' ' 29' ' ' ILE . 6.0 mt -124.25 137.65 56.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.444 -0.344 . . . . 0.77 110.187 -176.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -75.96 -47.72 23.95 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.626 -0.509 . . . . 1.85 109.626 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.426 ' O ' ' HA ' ' A' ' 54' ' ' SER . . . -141.23 96.65 3.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.987 0.423 . . . . 0.78 111.217 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -92.79 144.61 25.12 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.167 -0.469 . . . . 0.63 110.155 175.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 50.0 m -135.51 162.09 33.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.188 -0.46 . . . . 1.27 109.773 175.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -144.95 148.87 34.31 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.976 0.417 . . . . 0.64 110.845 -178.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -125.34 109.09 12.36 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.798 -0.816 . . . . 2.23 108.798 174.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 7.9 p -93.78 124.75 37.99 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.721 0.296 . . . . 1.38 111.688 -173.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.493 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 22.1 m-70 -147.95 174.19 12.13 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 121.183 0.516 . . . . 1.98 111.122 176.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.685 ' HB ' ' HD2' ' A' ' 97' ' ' PRO . 72.2 p -116.46 164.3 18.8 Favored Pre-proline 0 C--O 1.243 0.746 0 CA-C-N 116.014 -0.539 . . . . 0.76 111.451 -177.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.685 ' HD2' ' HB ' ' A' ' 96' ' ' THR . 14.5 Cg_endo -57.69 -20.75 44.1 Favored 'Trans proline' 0 C--O 1.219 -0.425 0 C-N-CA 122.826 2.35 . . . . 0.72 112.138 178.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.549 ' O ' ' HD2' ' A' ' 102' ' ' LYS . 4.0 mm? -62.46 -51.15 68.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.706 0.289 . . . . 2.08 110.236 177.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.574 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 3.4 mp0 -61.54 -46.32 90.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.398 . . . . 2.69 110.567 177.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -67.03 -42.49 84.78 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.517 -0.473 . . . . 1.46 111.75 -177.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.535 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 24.9 t70 -64.87 -33.04 75.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.855 0.36 . . . . 1.23 110.45 -178.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.613 ' O ' ' HG3' ' A' ' 106' ' ' LYS . 1.1 mpmm? -73.9 -20.3 60.44 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.518 -0.31 . . . . 2.66 110.978 177.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 82.1 mt -70.69 -49.73 44.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.082 0.468 . . . . 1.31 109.915 174.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.535 ' HG3' ' O ' ' A' ' 101' ' ' ASP . 2.7 ptmt -68.03 -23.68 65.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.08 -0.509 . . . . 1.84 110.778 174.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.552 ' HB3' ' HA ' ' A' ' 102' ' ' LYS . 44.2 t -74.92 -75.47 0.17 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.38 -0.373 . . . . 2.05 110.46 177.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.613 ' HG3' ' O ' ' A' ' 102' ' ' LYS . 10.8 pttt -97.42 -53.19 3.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.586 0.231 . . . . 4.02 111.023 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 109.07 -3.05 31.51 Favored Glycine 0 C--N 1.329 0.183 0 C-N-CA 120.612 -0.804 . . . . 3.92 112.899 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 8.2 t . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.756 -0.64 . . . . 4.98 109.63 179.633 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.2 ttp . . . . . 0 N--CA 1.482 1.134 0 N-CA-C 109.572 -0.529 . . . . 36.14 109.572 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 89.0 7.9 69.82 Favored Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 110.472 -1.051 . . . . 33.7 110.472 -171.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -96.66 87.05 4.24 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.0 -0.6 . . . . 32.35 110.091 -177.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.4 m -75.12 135.6 41.15 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.156 -0.475 . . . . 30.38 110.697 -179.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -112.97 117.92 33.39 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.716 -0.476 . . . . 28.39 109.716 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -122.58 99.36 6.36 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.04 0.448 . . . . 28.54 112.026 -176.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.8 m80 -78.38 136.28 37.64 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.814 -0.63 . . . . 26.47 109.502 170.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 78.3 m80 -77.24 115.19 16.81 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.11 -0.495 . . . . 24.34 109.94 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 7.2 p-80 -94.47 138.48 32.34 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.429 -0.582 . . . . 23.8 109.429 177.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 48.6 t-80 -93.22 98.33 11.21 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.873 -0.417 . . . . 20.9 109.873 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 21.3 t -68.33 127.9 34.63 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.242 -0.651 . . . . 19.89 109.242 178.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.0 t -114.35 153.38 29.91 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.944 0.402 . . . . 17.26 110.477 -175.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 158.61 65.52 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.593 -0.603 . . . . 16.67 111.593 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -94.89 -51.8 4.52 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.132 0.491 . . . . 19.13 109.857 -177.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -91.48 22.37 4.03 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.844 -0.616 . . . . 14.57 110.205 178.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -68.72 2.21 2.68 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.559 -0.746 . . . . 15.4 112.642 -175.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 mt -114.96 -10.99 12.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.009 0.433 . . . . 16.35 110.424 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -118.16 105.87 12.26 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.077 0.465 . . . . 15.41 111.299 -168.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 29.1 p90 -100.45 -10.84 20.71 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.785 -0.643 . . . . 11.39 111.108 178.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 57.37 42.02 25.49 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.156 -0.475 . . . . 10.77 111.97 177.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.3 31.92 2.59 Favored Glycine 0 CA--C 1.519 0.294 0 C-N-CA 120.885 -0.674 . . . . 6.73 113.07 -177.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 19.2 p80 -99.69 10.16 41.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.277 0.561 . . . . 6.08 110.27 177.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.2 mmt -110.73 166.62 10.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.59 -0.732 . . . . 4.41 109.467 175.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.492 ' O ' HG23 ' A' ' 28' ' ' VAL . 53.5 t -63.07 147.43 50.78 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.731 -0.47 . . . . 1.71 109.731 175.085 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.544 HD11 ' HB3' ' A' ' 86' ' ' ASN . 6.3 tp -49.49 -47.74 20.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 N-CA-C 112.19 0.441 . . . . 1.37 112.19 -175.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -63.72 -44.08 94.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.802 0.334 . . . . 1.75 110.322 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -64.73 -36.02 82.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.923 -0.58 . . . . 2.5 111.235 -178.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 24' ' ' CYS . 95.6 t -58.87 -55.54 22.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 N-CA-C 110.37 -0.233 . . . . 1.04 110.37 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.438 HG21 HD11 ' A' ' 87' ' ' ILE . 1.9 mp -66.19 -42.19 90.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.894 0.378 . . . . 0.79 110.586 -179.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -58.67 -52.2 66.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.909 -0.587 . . . . 2.2 111.534 -177.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -73.71 -31.29 63.32 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.413 -0.358 . . . . 1.67 110.81 -172.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 mmmp? -60.78 -55.57 31.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.209 -0.45 . . . . 2.03 111.578 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.411 HD12 ' N ' ' A' ' 34' ' ' SER . 4.0 pp -70.33 -26.58 63.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.73 0.3 . . . . 0.57 110.8 -179.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.477 ' O ' ' HA ' ' A' ' 38' ' ' LYS . 70.0 m -69.22 -34.17 74.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.765 0.316 . . . . 1.29 110.518 175.636 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.6 m -71.68 -34.32 69.58 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.909 0.385 . . . . 0.78 110.788 175.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.27 -54.85 7.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.012 -0.54 . . . . 0.64 111.92 -177.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.7 mt -89.25 -29.33 19.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.645 0.259 . . . . 0.94 111.066 -176.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.49 ' HE3' ' HB2' ' A' ' 38' ' ' LYS . 17.5 ttmt 60.99 78.78 0.3 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.737 -0.665 . . . . 3.36 111.33 176.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.487 ' HG2' ' HB2' ' A' ' 42' ' ' LEU . 59.1 Cg_endo -94.76 160.94 1.81 Allowed 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 123.309 2.673 . . . . 0.63 113.388 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 31.6 p -86.11 -39.82 16.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.665 0.745 . . . . 0.73 109.096 174.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.538 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 89.2 t80 -124.02 128.19 48.99 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.883 -1.053 . . . . 0.76 109.395 176.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.487 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 2.7 tm? -140.57 115.79 9.91 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.174 -0.676 . . . . 1.55 109.174 -178.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -130.37 132.43 45.8 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.832 0.348 . . . . 2.23 111.437 -177.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.8 mp -108.52 115.7 30.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.986 -0.552 . . . . 1.72 109.855 172.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.492 HG23 ' HB3' ' A' ' 56' ' ' ASP . 11.0 m -106.48 149.42 9.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.344 -0.389 . . . . 1.08 110.813 177.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -64.44 120.02 11.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.602 -0.726 . . . . 1.83 110.046 176.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.3 tttp -120.23 88.5 2.95 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.885 -0.783 . . . . 2.76 108.885 178.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.3 m -60.77 102.01 0.17 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.072 0.463 . . . . 3.2 111.741 -175.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 78.7 m -105.41 -66.98 0.94 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.818 -0.628 . . . . 4.74 109.562 173.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 157.14 144.7 4.0 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.08 -1.057 . . . . 3.16 113.42 175.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 71.5 m 57.82 83.92 0.11 Allowed 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 123.412 0.685 . . . . 4.36 112.733 174.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 100.42 -160.89 19.01 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.433 -0.889 . . . . 2.26 112.486 175.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.486 ' OG1' ' HA ' ' A' ' 87' ' ' ILE . 37.3 p -77.08 135.23 38.6 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.332 0.587 . . . . 3.46 111.527 -177.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.9 m -144.04 114.43 7.52 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.19 -0.67 . . . . 1.71 109.19 176.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -131.49 147.4 52.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.043 0.449 . . . . 1.15 111.74 -172.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.492 ' HB3' HG23 ' A' ' 45' ' ' VAL . 5.6 t70 -110.4 119.03 37.91 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.343 -0.984 . . . . 1.35 108.343 173.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -107.03 123.02 47.59 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.117 0.484 . . . . 0.51 111.786 -175.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.8 t -94.41 111.45 25.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.678 -0.692 . . . . 0.55 109.203 174.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.579 HG23 ' HA ' ' A' ' 94' ' ' CYS . 0.0 OUTLIER -108.97 115.66 50.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 121.562 0.696 . . . . 1.18 110.636 -178.111 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.538 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 85.3 t -112.3 106.17 20.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.025 -0.989 . . . . 0.58 109.029 176.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.506 ' HB3' HD11 ' A' ' 59' ' ' ILE . 29.8 t -145.04 154.8 42.9 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.413 0.523 . . . . 0.84 112.413 -172.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.738 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 0.9 OUTLIER -66.87 -19.48 65.74 Favored 'General case' 0 C--O 1.221 -0.419 0 CA-C-N 115.334 -0.848 . . . . 1.67 110.742 171.894 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -69.27 2.17 3.14 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.088 0.471 . . . . 1.81 111.028 -178.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -124.59 4.25 8.26 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.754 0.312 . . . . 3.19 111.126 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.738 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.2 OUTLIER -74.88 -9.6 58.7 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 121.892 -0.505 . . . . 2.14 111.636 -176.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.6 p-10 -87.44 -9.98 53.17 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.968 0.414 . . . . 2.03 109.995 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.8 ttpp 64.67 25.14 13.04 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.174 -0.921 . . . . 3.31 111.32 173.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.536 ' HE3' HD11 ' A' ' 70' ' ' LEU . 30.4 mmmt -94.67 89.83 5.89 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.358 0.599 . . . . 1.99 109.617 176.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.471 HD12 ' N ' ' A' ' 70' ' ' LEU . 4.0 pp -69.19 -30.31 68.47 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.763 -0.653 . . . . 2.33 110.994 -174.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.536 HD11 ' HE3' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -67.32 -33.88 76.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.651 0.263 . . . . 1.09 110.573 177.204 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.5 ' N ' HD22 ' A' ' 70' ' ' LEU . 25.5 t70 -74.22 -40.21 62.6 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.676 -0.49 . . . . 2.08 109.676 178.188 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -59.11 -44.44 91.99 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.425 -0.583 . . . . 2.93 109.425 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -57.7 -55.25 37.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.662 -0.699 . . . . 1.21 111.255 178.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.458 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 2.3 ptm180 -61.5 -41.51 97.39 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 111.784 0.29 . . . . 1.67 111.784 -175.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.5 mt -64.18 -50.88 66.39 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.883 0.373 . . . . 1.48 110.786 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.412 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 54.1 t -56.28 -45.7 81.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.84 -0.618 . . . . 0.82 110.92 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -64.36 -31.29 72.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.633 -0.258 . . . . 1.14 111.413 -178.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 85.2 m -66.03 -49.32 68.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.572 -0.286 . . . . 0.69 111.408 -178.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.1 mp -79.45 -46.0 23.27 Favored 'Isoleucine or valine' 0 C--O 1.242 0.666 0 CA-C-O 121.364 0.602 . . . . 0.77 110.701 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.838 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.8 mp -73.15 -5.46 39.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.074 -0.512 . . . . 0.78 111.711 -175.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -49.46 -63.94 0.95 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.215 -0.291 . . . . 1.93 110.215 171.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.472 ' O ' ' HG2' ' A' ' 85' ' ' GLN . 6.0 tp10 -75.1 -37.6 61.45 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.264 0.554 . . . . 2.91 110.507 175.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.838 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 3.8 tp10 -53.01 -55.15 25.78 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.412 -0.813 . . . . 1.66 112.603 -174.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.652 ' HG ' ' HB3' ' A' ' 80' ' ' LEU . 55.3 mt -50.4 -30.53 12.62 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.846 -1.07 . . . . 0.58 113.386 -176.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.472 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 19.5 mm-40 -51.16 -27.35 8.44 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.018 0.372 . . . . 0.92 111.67 -176.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.544 ' HB3' HD11 ' A' ' 25' ' ' ILE . 44.5 m-80 -77.74 -24.82 48.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.386 -0.37 . . . . 1.02 111.337 -178.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.486 ' HA ' ' OG1' ' A' ' 53' ' ' THR . 1.8 mt -103.64 156.87 5.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.451 -0.574 . . . . 0.77 109.451 -176.265 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 39.4 t60 -98.46 -36.73 9.85 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.548 -0.461 . . . . 1.85 110.173 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -147.54 96.84 2.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.118 -0.492 . . . . 0.78 110.679 178.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -101.09 136.09 41.49 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.174 -0.466 . . . . 0.63 110.887 178.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 33.0 t -125.76 152.51 45.28 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.111 -0.7 . . . . 1.27 109.111 177.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -143.39 134.72 26.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.306 0.574 . . . . 0.64 111.505 -177.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -117.42 109.28 16.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.646 -0.706 . . . . 2.23 109.412 174.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.579 ' HA ' HG23 ' A' ' 59' ' ' ILE . 7.5 p -92.77 130.62 38.32 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.276 0.56 . . . . 1.38 111.555 -176.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.414 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 40.3 m80 -143.88 167.08 23.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.586 -0.733 . . . . 1.98 110.017 178.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 39.1 p -101.63 159.15 30.26 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 116.238 -0.437 . . . . 0.76 110.006 176.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -58.68 -29.44 89.43 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.252 1.968 . . . . 0.72 111.166 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.85 -45.48 70.97 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.542 -0.754 . . . . 2.08 109.781 177.129 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.483 ' HA ' ' CE ' ' A' ' 102' ' ' LYS . 8.5 tp10 -61.95 -42.55 99.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.044 0.449 . . . . 2.69 110.284 177.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.614 ' O ' ' HG2' ' A' ' 104' ' ' LYS . 64.9 t80 -64.66 -32.53 74.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.683 -0.689 . . . . 1.46 110.429 178.062 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -59.45 -36.49 76.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.052 -0.522 . . . . 1.23 111.266 -178.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.483 ' CE ' ' HA ' ' A' ' 99' ' ' GLU . 0.0 OUTLIER -63.64 -44.66 93.19 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.962 -0.295 . . . . 2.66 110.518 176.592 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 51.7 mt -63.04 -51.5 66.49 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.177 -0.465 . . . . 1.31 110.948 -176.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.614 ' HG2' ' O ' ' A' ' 100' ' ' TYR . 19.3 ptmt -68.35 -18.72 64.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.796 -0.638 . . . . 1.84 111.755 -177.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 47.4 t -62.12 -26.26 68.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.834 0.349 . . . . 2.05 111.041 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.453 ' HE3' ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -117.71 -39.48 3.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.021 0.439 . . . . 4.02 110.532 176.747 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 104.7 47.82 1.15 Allowed Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.999 -0.619 . . . . 3.92 111.699 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 24.1 m . . . . . 0 C--O 1.252 1.211 0 CA-C-O 118.491 -0.766 . . . . 4.98 109.828 -179.547 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 tpt . . . . . 0 N--CA 1.48 1.073 0 CA-C-O 120.942 0.401 . . . . 36.14 110.519 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 166.42 168.05 28.02 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 111.131 -0.788 . . . . 33.7 111.131 178.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.1 t -74.83 90.3 2.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.283 0.563 . . . . 32.35 109.831 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.6 m -84.68 91.87 8.04 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.901 -0.591 . . . . 30.38 110.991 -176.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 59.5 m-70 -95.41 -172.36 2.62 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.191 -0.459 . . . . 28.39 110.485 179.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 -124.38 -47.41 1.87 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.708 -0.478 . . . . 28.54 109.708 178.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 69.38 -52.79 0.6 Allowed 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.275 1.03 . . . . 26.47 111.673 178.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 -64.23 135.27 56.12 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.96 -0.755 . . . . 24.34 108.96 177.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 46.6 m80 -84.54 -79.38 0.22 Allowed 'General case' 0 C--N 1.323 -0.582 0 O-C-N 123.388 0.43 . . . . 23.8 112.042 -167.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -143.53 133.52 24.15 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.358 -0.383 . . . . 20.9 110.147 -172.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.5 m -105.05 -163.34 0.95 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.192 -0.458 . . . . 19.89 110.143 -178.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.7 m -98.0 70.86 2.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.239 0.542 . . . . 17.26 110.578 176.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.467 ' HA3' ' HG3' ' A' ' 43' ' ' GLU . . . -117.38 23.76 9.55 Favored Glycine 0 N--CA 1.452 -0.24 0 N-CA-C 110.601 -1.0 . . . . 16.67 110.601 178.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -67.66 -32.47 73.18 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.392 -0.904 . . . . 19.13 111.631 -175.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -129.45 12.55 5.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.143 0.497 . . . . 14.57 110.582 -173.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -73.18 -6.51 46.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.973 -0.558 . . . . 15.4 111.207 -173.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -71.97 -1.31 14.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.445 -0.343 . . . . 16.35 111.893 -174.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -97.24 131.7 43.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.899 0.381 . . . . 15.41 110.473 177.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -90.03 -30.58 17.65 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.01 -0.541 . . . . 11.39 110.284 -174.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 66.58 19.54 10.83 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.263 -0.88 . . . . 10.77 111.041 177.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.03 -2.53 86.73 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.995 -0.621 . . . . 6.73 112.783 178.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 32.2 m170 -96.39 107.86 20.31 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.737 -0.272 . . . . 6.08 110.403 -178.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.8 ptt? -79.81 65.7 5.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.684 0.754 . . . . 4.41 110.831 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 33.7 m -68.82 155.97 39.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.378 -0.828 . . . . 1.71 110.126 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.9 tp -56.1 -35.62 42.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 O-C-N 123.075 0.235 . . . . 1.37 110.893 -178.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.52 HE21 ' HG ' ' A' ' 44' ' ' LEU . 39.0 tt0 -53.27 -49.98 65.8 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.86 0.362 . . . . 1.75 110.763 175.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.456 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 70.3 mmtt -71.32 -23.89 62.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.965 -0.562 . . . . 2.5 112.187 -174.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 46.4 t -67.22 -52.21 45.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-O 121.163 0.506 . . . . 1.04 109.844 176.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.416 HG13 ' OE1' ' A' ' 83' ' ' GLU . 1.8 mp -60.42 -48.56 87.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.413 -0.812 . . . . 0.79 109.905 175.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -56.4 -49.71 73.72 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.086 -0.961 . . . . 2.2 111.117 -178.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -56.33 -50.74 70.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.146 -0.479 . . . . 1.67 111.767 -177.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.3 mtmp? -63.28 -46.83 84.94 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.415 0.524 . . . . 2.03 112.415 -175.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.447 HD12 ' N ' ' A' ' 34' ' ' SER . 4.3 pp -71.42 -28.83 64.27 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.24 -0.584 . . . . 0.57 110.848 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.447 ' N ' HD12 ' A' ' 33' ' ' LEU . 23.1 t -69.21 -36.93 77.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.931 0.396 . . . . 1.29 110.149 177.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.1 m -71.6 -28.0 63.51 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.409 -0.359 . . . . 0.78 111.189 178.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.09 -54.92 5.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.313 -0.403 . . . . 0.64 112.005 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.6 mp -88.86 -25.68 22.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.601 0.238 . . . . 0.94 110.639 -177.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.459 ' HE2' ' HB2' ' A' ' 38' ' ' LYS . 19.9 ttmm 59.82 78.18 0.35 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.56 -0.746 . . . . 3.36 111.373 177.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.847 ' HA ' ' HB3' ' A' ' 61' ' ' SER . 97.4 Cg_endo -93.0 157.93 2.68 Favored 'Trans proline' 0 N--CA 1.451 -1.024 0 C-N-CA 123.177 2.585 . . . . 0.63 113.167 -177.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.0 p -89.65 -28.05 19.74 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.813 -0.63 . . . . 0.73 109.826 175.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.431 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 83.4 t80 -138.3 139.77 39.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.687 -0.688 . . . . 0.76 110.13 178.233 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.631 HD22 ' HA ' ' A' ' 59' ' ' ILE . 0.2 OUTLIER -142.21 116.36 9.45 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.228 -0.656 . . . . 1.55 109.228 179.135 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.467 ' HG3' ' HA3' ' A' ' 13' ' ' GLY . 21.4 tt0 -114.54 127.78 55.98 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.947 0.403 . . . . 2.23 110.263 177.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.52 ' HG ' HE21 ' A' ' 26' ' ' GLN . 3.7 mm? -98.94 115.79 29.7 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.765 -0.652 . . . . 1.72 110.214 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.534 ' HB ' ' HB3' ' A' ' 56' ' ' ASP . 29.6 t -103.49 146.22 11.46 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.453 -0.794 . . . . 1.08 109.32 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -69.79 129.87 40.75 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.832 -0.433 . . . . 1.83 109.832 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.682 ' HA ' ' HE3' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -72.41 -31.9 65.9 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.047 0.451 . . . . 2.76 110.044 -179.883 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.2 t -172.68 98.91 0.14 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.426 -0.806 . . . . 3.2 109.069 -178.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 70.9 m -54.37 110.9 0.68 Allowed 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.741 -0.663 . . . . 4.74 110.768 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 143.47 -31.49 1.92 Allowed Glycine 0 N--CA 1.442 -0.913 0 CA-C-N 115.069 -0.968 . . . . 3.16 111.334 -177.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 57.9 m -131.29 105.03 7.38 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.891 0.377 . . . . 4.36 110.359 178.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -83.84 54.27 4.93 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.992 -0.623 . . . . 2.26 112.303 -178.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.7 t -126.4 -1.31 6.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.299 0.571 . . . . 3.46 110.657 -179.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.0 p -137.77 138.29 39.1 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.377 -0.374 . . . . 1.71 110.288 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -128.3 152.45 48.12 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.251 0.548 . . . . 1.15 111.652 -175.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.534 ' HB3' ' HB ' ' A' ' 45' ' ' VAL . 13.7 t70 -113.67 134.2 54.87 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.232 -1.025 . . . . 1.35 108.232 174.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -125.31 120.99 32.71 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.279 0.561 . . . . 0.51 112.378 -174.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.3 t -92.52 110.98 23.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.484 -0.78 . . . . 0.55 108.996 171.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.631 ' HA ' HD22 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -105.4 120.47 56.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.252 -0.431 . . . . 1.18 110.576 -176.899 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.482 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 58.1 t -115.79 106.92 21.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.73 -0.668 . . . . 0.58 110.373 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.847 ' HB3' ' HA ' ' A' ' 39' ' ' PRO . 86.9 p -153.37 153.09 31.9 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.884 0.374 . . . . 0.84 111.048 -179.019 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.851 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 23.9 m-80 -67.17 -19.35 65.57 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.122 -0.49 . . . . 1.67 112.078 175.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -52.5 -25.43 10.25 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.868 -0.52 . . . . 1.81 111.505 -177.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -100.37 -1.34 36.28 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.685 0.624 . . . . 3.19 112.685 -174.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.851 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -72.98 -15.59 61.54 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.542 -0.724 . . . . 2.14 111.669 -178.938 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -80.18 5.25 14.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.136 0.493 . . . . 2.03 110.317 -178.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt 62.58 26.74 15.86 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.355 -0.839 . . . . 3.31 110.803 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.615 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 71.0 mmtt -83.77 97.9 9.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.912 -0.586 . . . . 1.99 111.799 -177.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -73.69 -44.11 57.45 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 115.404 -0.817 . . . . 2.33 108.906 175.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.485 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.74 -33.17 74.34 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.012 -0.54 . . . . 1.09 111.503 -178.042 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.615 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 30.6 t70 -66.82 -50.29 63.08 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 109.749 -0.463 . . . . 2.08 109.749 177.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -57.42 -43.64 83.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.74 -0.664 . . . . 2.93 109.591 176.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -61.45 -50.94 70.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.658 -0.701 . . . . 1.21 111.708 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.07 -35.81 66.74 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.072 -0.251 . . . . 1.67 111.319 -174.358 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.0 mp -64.3 -50.09 69.21 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.792 0.33 . . . . 1.48 110.801 177.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.799 HG13 HD22 ' A' ' 80' ' ' LEU . 42.0 t -58.73 -47.52 88.77 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.4 0 CA-C-N 116.048 -0.524 . . . . 0.82 110.976 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.441 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 13.2 m-80 -62.47 -38.26 89.15 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.905 -0.318 . . . . 1.14 111.702 -178.255 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 87.6 m -61.4 -57.87 10.5 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.06 0.393 . . . . 0.69 112.06 -177.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.402 ' N ' HD12 ' A' ' 79' ' ' ILE . 3.7 mp -81.37 -46.09 20.47 Favored 'Isoleucine or valine' 0 C--O 1.239 0.522 0 CA-C-O 121.457 0.646 . . . . 0.77 110.839 -175.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.869 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.6 mp -74.55 -5.35 42.32 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.867 -0.606 . . . . 0.78 111.504 -175.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 20.5 tptm -49.73 -63.64 1.05 Allowed 'General case' 0 C--O 1.227 -0.117 0 N-CA-C 109.772 -0.455 . . . . 1.93 109.772 169.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -75.2 -30.19 60.57 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.294 0.569 . . . . 2.91 110.322 179.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.869 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 6.7 tp10 -56.8 -55.59 32.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.553 -0.748 . . . . 1.66 112.001 -179.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.658 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 75.0 mt -50.37 -30.77 13.0 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.173 -0.921 . . . . 0.58 112.634 -178.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 22.2 mm-40 -52.76 -30.76 34.62 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 120.954 0.407 . . . . 0.92 111.163 -176.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -96.57 5.36 50.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.199 -0.455 . . . . 1.02 111.395 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 9.1 mt -122.89 136.62 59.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.507 -0.315 . . . . 0.77 110.285 -178.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -73.38 -38.68 65.58 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.939 0.399 . . . . 1.85 110.226 179.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.32 102.0 1.09 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.899 -0.592 . . . . 0.78 110.416 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -94.64 140.22 30.16 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.388 -0.369 . . . . 0.63 110.221 177.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 9.8 m -128.83 140.19 51.82 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.335 -0.617 . . . . 1.27 109.335 176.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -129.71 133.3 46.97 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.149 0.5 . . . . 0.64 110.909 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 42.1 tptt -124.34 116.36 22.47 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.996 -0.547 . . . . 2.23 109.927 174.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.559 ' HA ' HG23 ' A' ' 59' ' ' ILE . 65.9 m -89.22 134.37 34.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.835 -0.621 . . . . 1.38 111.753 -173.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.482 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 55.9 m-70 -136.84 153.48 50.77 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.187 -0.915 . . . . 1.98 109.393 175.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.45 HG21 ' HB3' ' A' ' 65' ' ' GLU . 0.6 OUTLIER -93.54 150.71 39.31 Favored Pre-proline 0 C--N 1.314 -0.958 0 CA-C-N 116.282 -0.417 . . . . 0.76 110.173 174.579 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.536 ' HG2' ' ND2' ' A' ' 62' ' ' ASN . 50.3 Cg_exo -57.09 -31.85 91.54 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.707 2.271 . . . . 0.72 112.072 -179.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.406 ' O ' ' HE3' ' A' ' 102' ' ' LYS . 3.1 mm? -67.64 -50.86 55.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.528 -0.76 . . . . 2.08 110.229 176.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.67 -27.31 66.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.541 -0.299 . . . . 2.69 111.636 -178.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -73.77 -32.69 63.92 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.766 -0.457 . . . . 1.46 109.766 173.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.556 ' HA ' ' HE3' ' A' ' 104' ' ' LYS . 12.9 t70 -59.5 -42.64 92.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.809 -0.632 . . . . 1.23 109.855 177.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.406 ' HE3' ' O ' ' A' ' 98' ' ' LEU . 0.0 OUTLIER -56.8 -32.57 65.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.899 -0.591 . . . . 2.66 110.985 177.12 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 70.2 mt -79.11 -40.2 31.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 1.31 112.088 -176.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.563 ' HD2' ' N ' ' A' ' 105' ' ' SER . 0.1 OUTLIER -91.0 -28.73 17.81 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.503 0.557 . . . . 1.84 112.503 -175.301 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.563 ' N ' ' HD2' ' A' ' 104' ' ' LYS . 60.5 m -73.49 -37.49 65.69 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.902 -0.319 . . . . 2.05 111.096 -177.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.16 -172.01 3.73 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.105 0.478 . . . . 4.02 111.307 -178.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -129.34 4.81 6.3 Favored Glycine 0 N--CA 1.451 -0.361 0 CA-C-N 115.468 -0.787 . . . . 3.92 111.33 177.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 18.9 t . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.464 -0.779 . . . . 4.98 109.022 179.698 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.9 mtt . . . . . 0 N--CA 1.482 1.161 0 CA-C-O 120.53 0.205 . . . . 36.14 110.478 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 77.95 -125.4 7.2 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.809 -0.71 . . . . 33.7 111.542 -178.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 6.3 t -142.94 126.53 16.89 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.498 -0.556 . . . . 32.35 109.498 176.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.5 m -83.79 85.01 7.36 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.038 0.447 . . . . 30.38 111.163 -175.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 25.9 m-70 -119.42 80.42 1.56 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.436 0.636 . . . . 28.39 111.147 177.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -157.17 96.5 1.58 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.118 -0.946 . . . . 28.54 108.565 174.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 59.7 t60 -95.35 131.15 41.76 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.716 -0.675 . . . . 26.47 111.857 -170.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -139.34 126.47 21.21 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.328 -0.851 . . . . 24.34 109.699 171.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -82.15 71.57 9.2 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.796 -0.816 . . . . 23.8 108.796 176.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.473 ' CD2' ' HG3' ' A' ' 15' ' ' GLU . 0.9 OUTLIER -84.1 174.43 10.27 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.06 -0.973 . . . . 20.9 111.243 -178.701 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.8 m -54.32 126.65 24.04 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.569 -0.741 . . . . 19.89 111.631 -176.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 28.7 m -78.01 88.35 4.16 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.484 0.659 . . . . 17.26 110.306 178.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 171.0 -78.79 0.09 OUTLIER Glycine 0 N--CA 1.442 -0.903 0 CA-C-N 114.966 -1.015 . . . . 16.67 111.277 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -58.01 -27.77 63.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.472 -0.364 . . . . 19.13 111.719 -176.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.473 ' HG3' ' CD2' ' A' ' 10' ' ' HIS . 12.8 pt-20 -145.65 36.63 1.07 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.968 0.413 . . . . 14.57 111.315 -174.133 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.531 HD21 ' HG3' ' A' ' 43' ' ' GLU . 3.1 p30 -96.68 -18.49 19.65 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.513 -0.475 . . . . 15.4 111.074 -178.071 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -82.05 5.18 20.25 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.63 -0.259 . . . . 16.35 111.519 -176.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -81.53 -179.37 7.35 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.485 0.66 . . . . 15.41 112.165 -176.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 14.3 p90 -68.15 -8.45 38.68 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.112 -0.949 . . . . 11.39 113.48 -171.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.546 HE21 ' N ' ' A' ' 21' ' ' GLY . 0.4 OUTLIER -74.2 -14.46 60.94 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.095 0.474 . . . . 10.77 110.333 -177.936 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.546 ' N ' HE21 ' A' ' 20' ' ' GLN . . . -91.98 74.06 1.5 Allowed Glycine 0 N--CA 1.446 -0.684 0 CA-C-N 115.806 -0.633 . . . . 6.73 111.824 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.437 ' HB3' ' H ' ' A' ' 23' ' ' MET . 1.8 m80 -102.32 -156.28 0.55 Allowed 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.523 -0.177 . . . . 6.08 110.523 178.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.437 ' H ' ' HB3' ' A' ' 22' ' ' HIS . 26.7 ptt? -50.3 129.41 21.5 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.374 0.607 . . . . 4.41 111.801 -175.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.511 ' O ' HG23 ' A' ' 28' ' ' VAL . 48.2 t -176.27 164.51 2.69 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.85 -1.167 . . . . 1.71 107.85 -175.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 7.0 tp -59.08 -38.7 75.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.106 0.479 . . . . 1.37 110.218 177.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -63.4 -39.27 94.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.912 -0.586 . . . . 1.75 110.165 176.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -69.66 -33.83 73.14 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.98 -0.555 . . . . 2.5 110.782 -179.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 24' ' ' CYS . 94.8 t -57.61 -53.02 50.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 110.202 -0.296 . . . . 1.04 110.202 176.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.9 mp -68.08 -45.35 83.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.244 -0.434 . . . . 0.79 111.181 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -61.38 -52.27 65.31 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.648 0.261 . . . . 2.2 110.934 -176.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -69.56 -27.17 64.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.491 -0.322 . . . . 1.67 110.786 -176.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.403 ' HE2' ' HB3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -62.61 -55.65 25.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.189 -0.46 . . . . 2.03 111.172 178.489 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.431 HD12 ' N ' ' A' ' 34' ' ' SER . 3.8 pp -74.26 -30.11 61.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.538 -0.301 . . . . 0.57 111.135 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.431 ' N ' HD12 ' A' ' 33' ' ' LEU . 23.1 t -63.9 -51.59 63.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.419 -0.355 . . . . 1.29 110.837 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.0 m -71.27 -27.23 63.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.568 -0.287 . . . . 0.78 111.284 -177.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.28 -53.89 7.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.522 -0.308 . . . . 0.64 111.678 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.4 mt -83.49 -34.97 25.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.525 -0.307 . . . . 0.94 111.344 -176.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.4 mttp 62.83 85.71 0.16 Allowed Pre-proline 0 N--CA 1.464 0.233 0 CA-C-N 115.636 -0.711 . . . . 3.36 111.927 -177.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.419 ' HG2' ' HB2' ' A' ' 42' ' ' LEU . 94.4 Cg_endo -94.49 157.89 1.98 Allowed 'Trans proline' 0 N--CA 1.45 -1.067 0 C-N-CA 123.164 2.576 . . . . 0.63 112.162 175.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 21.5 p -78.81 -29.48 44.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.413 0.625 . . . . 0.73 109.539 176.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.491 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 82.9 t80 -141.68 134.49 28.7 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.068 -0.969 . . . . 0.76 109.841 175.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.419 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 1.2 tm? -140.63 112.72 7.75 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.024 -0.732 . . . . 1.55 109.024 178.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.531 ' HG3' HD21 ' A' ' 16' ' ' ASN . 39.0 tt0 -113.37 122.32 47.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.76 -0.459 . . . . 2.23 109.76 177.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.457 HD11 ' HB3' ' A' ' 55' ' ' PHE . 0.1 OUTLIER -97.97 115.36 28.01 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.618 -0.512 . . . . 1.72 109.618 179.727 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 39.0 t -112.93 135.34 52.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 116.594 -0.276 . . . . 1.08 110.81 -176.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -67.72 112.86 5.05 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.211 -0.663 . . . . 1.83 109.211 171.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.422 ' HB3' ' OG ' ' A' ' 54' ' ' SER . 56.4 tttp -82.94 -27.76 30.32 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.784 -0.644 . . . . 2.76 110.787 -173.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.0 m 57.25 27.83 14.24 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.916 -0.583 . . . . 3.2 111.47 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 37.4 t -87.5 108.85 19.22 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.554 -0.535 . . . . 4.74 109.554 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 88.79 -116.19 4.6 Favored Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 120.587 -0.816 . . . . 3.16 111.289 -176.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 76.7 m -152.47 155.74 38.09 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.067 -0.345 . . . . 4.36 110.067 178.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.07 -140.26 22.08 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.925 -0.655 . . . . 2.26 112.788 176.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.5 p -75.2 102.39 4.97 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 121.508 0.67 . . . . 3.46 111.172 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.422 ' OG ' ' HB3' ' A' ' 47' ' ' LYS . 32.6 t -125.31 114.11 18.47 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.06 -0.718 . . . . 1.71 109.06 176.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.457 ' HB3' HD11 ' A' ' 44' ' ' LEU . 41.9 m-85 -124.67 132.62 53.39 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.858 0.361 . . . . 1.15 111.268 -172.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -115.46 114.46 25.07 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 107.423 -1.325 . . . . 1.35 107.423 171.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.05 117.76 34.88 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.026 0.441 . . . . 0.51 111.523 -172.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.8 t -80.4 110.78 16.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 108.985 -0.746 . . . . 0.55 108.985 173.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -112.65 112.6 41.14 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.663 0.744 . . . . 1.18 110.376 -176.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.528 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 75.3 t -110.26 108.72 26.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.082 -0.963 . . . . 0.58 108.931 175.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.1 t -149.04 155.04 40.17 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.359 0.6 . . . . 0.84 112.402 -172.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -66.99 -19.44 65.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 114.922 -1.035 . . . . 1.67 111.602 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 35.0 p30 -68.33 -25.39 65.09 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.852 -0.339 . . . . 1.81 111.244 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.489 ' HD2' HG23 ' A' ' 96' ' ' THR . 57.6 t80 -85.72 -12.78 50.28 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.454 0.645 . . . . 3.19 109.723 176.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.47 -24.64 34.14 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.299 -0.864 . . . . 2.14 109.027 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -67.49 -21.25 65.52 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.325 -0.852 . . . . 2.03 109.065 173.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt 65.06 23.66 12.47 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.005 -0.998 . . . . 3.31 110.966 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -90.74 89.82 7.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.956 -0.566 . . . . 1.99 110.098 177.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.4 tt -61.65 -49.83 74.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.437 -0.801 . . . . 2.33 110.733 -175.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.416 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -63.49 -31.66 72.89 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.716 0.265 . . . . 1.09 111.716 -178.586 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.65 ' O ' ' HG2' ' A' ' 74' ' ' ARG . 12.4 m-20 -73.98 -46.23 45.13 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.113 -0.235 . . . . 2.08 111.42 -179.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.406 ' O ' HG23 ' A' ' 76' ' ' VAL . 0.0 OUTLIER -67.3 -26.68 66.64 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.391 -0.524 . . . . 2.93 109.92 176.479 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -70.94 -48.01 55.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.066 -0.516 . . . . 1.21 110.473 176.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.65 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 7.7 ptm180 -63.69 -34.69 78.42 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.524 -0.307 . . . . 1.67 110.759 -178.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 95.3 mt -68.03 -50.12 57.3 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.378 -0.374 . . . . 1.48 110.2 177.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.582 HG13 HD22 ' A' ' 80' ' ' LEU . 43.5 t -57.4 -41.34 78.34 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 CA-C-N 116.019 -0.537 . . . . 0.82 110.781 178.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -62.15 -45.74 92.06 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.775 0.321 . . . . 1.14 111.203 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 59.1 m -65.52 -45.86 81.84 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.038 0.447 . . . . 0.69 111.361 -175.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 47.3 mt -77.46 -50.68 19.84 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 CA-C-O 121.464 0.65 . . . . 0.77 110.985 -176.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.855 ' HA ' ' CB ' ' A' ' 83' ' ' GLU . 9.7 mp -77.27 -3.97 42.53 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.636 -0.711 . . . . 0.78 111.903 -173.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.2 tptt -52.35 -63.68 1.06 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.601 -0.518 . . . . 1.93 109.601 172.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -75.53 -30.56 59.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.438 -0.347 . . . . 2.91 111.243 174.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.855 ' CB ' ' HA ' ' A' ' 80' ' ' LEU . 2.6 tp10 -54.28 -54.7 36.67 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.048 0.451 . . . . 1.66 111.585 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 66.0 mt -50.34 -30.86 13.09 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.203 -0.908 . . . . 0.58 112.317 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -54.19 -28.14 38.64 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.757 0.313 . . . . 0.92 111.128 -177.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -90.34 -6.89 54.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.869 0.366 . . . . 1.02 111.136 -178.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.531 HG21 ' HB2' ' A' ' 90' ' ' PHE . 4.2 mt -114.9 146.49 19.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.297 -0.411 . . . . 0.77 109.944 -175.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 60.9 t60 -95.01 -28.7 14.99 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.848 0.356 . . . . 1.85 110.079 176.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -158.68 95.58 1.32 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.18 -0.464 . . . . 0.78 110.994 178.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . 0.531 ' HB2' HG21 ' A' ' 87' ' ' ILE . 81.9 t80 -99.39 144.5 28.43 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.222 -0.445 . . . . 0.63 110.702 176.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 51.1 m -142.82 147.45 35.47 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.458 -0.571 . . . . 1.27 109.458 173.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -115.19 137.15 52.34 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.279 0.561 . . . . 0.64 111.248 -177.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -111.62 108.84 18.46 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 107.955 -1.128 . . . . 2.23 107.955 175.229 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 6.3 p -100.1 128.57 46.16 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.414 0.524 . . . . 1.38 112.414 -169.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.528 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 44.5 m80 -141.58 159.79 41.49 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-O 121.543 0.687 . . . . 1.98 111.52 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.489 HG23 ' HD2' ' A' ' 64' ' ' PHE . 0.6 OUTLIER -103.28 149.6 37.12 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 114.932 -1.031 . . . . 0.76 110.67 177.362 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.528 ' HA ' ' HB3' ' A' ' 100' ' ' TYR . 22.2 Cg_endo -61.79 -24.81 77.85 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.838 2.359 . . . . 0.72 112.876 -178.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.429 HD22 ' HA ' ' A' ' 98' ' ' LEU . 0.3 OUTLIER -61.87 -51.41 68.33 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.803 -0.443 . . . . 2.08 109.803 179.047 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 19.7 mp0 -72.77 -33.36 66.26 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.084 -0.507 . . . . 2.69 111.118 177.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.528 ' HB3' ' HA ' ' A' ' 97' ' ' PRO . 50.0 t80 -58.65 -39.84 81.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.428 -0.351 . . . . 1.46 111.241 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -57.16 -36.1 70.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.997 0.427 . . . . 1.23 110.657 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.712 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.5 OUTLIER -70.44 -35.76 73.55 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.191 -0.459 . . . . 2.66 110.396 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 86.3 mt -65.18 -43.43 91.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 1.31 111.12 -178.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.2 ptmt -75.84 -31.29 59.27 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.373 -0.376 . . . . 1.84 111.023 178.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.3 t -70.04 -42.64 72.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.782 0.325 . . . . 2.05 110.736 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.651 ' HE2' ' HB2' ' A' ' 108' ' ' SER . 22.7 ptmt -70.84 -46.23 63.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.11 0.481 . . . . 4.02 109.947 177.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 100.74 40.21 2.97 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.953 -0.641 . . . . 3.92 111.791 178.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.651 ' HB2' ' HE2' ' A' ' 106' ' ' LYS . 67.8 m . . . . . 0 C--O 1.249 1.026 0 CA-C-O 118.096 -0.954 . . . . 4.98 109.459 178.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 N--CA 1.48 1.064 0 N-CA-C 110.062 -0.348 . . . . 36.14 110.062 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -153.32 54.26 0.45 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.718 -0.753 . . . . 33.7 112.24 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.6 m -114.63 110.67 20.13 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.823 0.344 . . . . 32.35 110.602 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 32.5 t -127.41 109.37 11.7 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.065 -0.516 . . . . 30.38 109.967 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.8 p80 -140.42 119.16 12.45 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.141 0.496 . . . . 28.39 110.971 -179.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 57.0 m-70 -112.31 105.24 13.48 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.072 -0.513 . . . . 28.54 110.231 175.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 75.8 t60 -75.32 111.04 10.18 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.115 -0.493 . . . . 26.47 110.402 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.5 m-70 -88.59 86.58 7.03 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.391 0.615 . . . . 24.34 111.015 -177.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 61.4 t60 -177.83 81.39 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.842 -1.072 . . . . 23.8 108.385 175.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.5 p80 -91.03 121.94 33.27 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.792 -0.64 . . . . 20.9 110.947 -175.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.634 ' HB2' ' HG2' ' A' ' 14' ' ' ARG . 16.3 m -75.36 148.17 39.46 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.282 -0.636 . . . . 19.89 109.282 174.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.6 m -94.68 105.84 17.8 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.112 0.482 . . . . 17.26 111.341 -174.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 93.78 40.46 4.66 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-N 115.81 -0.632 . . . . 16.67 112.426 177.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.634 ' HG2' ' HB2' ' A' ' 11' ' ' SER . 38.8 mtm180 -65.89 -38.9 89.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.24 0.543 . . . . 19.13 110.696 -179.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -86.45 30.78 0.69 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.764 -0.653 . . . . 14.57 111.558 -176.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -66.14 -13.28 59.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.405 -0.361 . . . . 15.4 110.888 178.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.3 mp -70.63 -28.48 64.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.341 0.591 . . . . 16.35 109.813 174.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -96.81 167.74 10.92 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.379 -0.828 . . . . 15.41 109.796 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.462 ' CE2' ' HA3' ' A' ' 21' ' ' GLY . 17.0 p90 -96.73 15.57 21.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.446 -0.343 . . . . 11.39 111.095 -176.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 63.86 35.23 11.16 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.825 -0.625 . . . . 10.77 110.606 179.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.462 ' HA3' ' CE2' ' A' ' 19' ' ' PHE . . . -103.15 66.08 0.36 Allowed Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.825 -0.702 . . . . 6.73 112.057 -179.123 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 13.9 m-70 -80.24 -67.73 0.74 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.006 -1.109 . . . . 6.08 108.006 176.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.4 mtt -128.1 89.86 2.99 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.828 -1.078 . . . . 4.41 108.789 171.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.525 ' O ' HG23 ' A' ' 28' ' ' VAL . 53.3 t -58.88 119.6 7.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.876 -0.602 . . . . 1.71 110.523 -178.126 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.9 tp -52.54 -31.99 16.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 O-C-N 123.642 0.589 . . . . 1.37 111.714 -177.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -60.64 -54.87 40.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.903 0.382 . . . . 1.75 110.101 176.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.1 tttp -71.98 -21.8 61.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.155 -0.475 . . . . 2.5 111.495 -178.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.525 HG23 ' O ' ' A' ' 24' ' ' CYS . 72.9 t -59.64 -45.26 94.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 109.644 -0.502 . . . . 1.04 109.644 174.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.12 -41.17 88.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.945 -0.571 . . . . 0.79 110.102 175.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 34' ' ' SER . 68.7 mt-10 -53.76 -52.22 60.88 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.22 -0.446 . . . . 2.2 111.037 178.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -75.43 -30.9 60.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.977 -0.556 . . . . 1.67 110.919 -174.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -60.68 -52.56 64.63 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.273 -0.421 . . . . 2.03 110.718 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -74.23 -26.03 60.01 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.847 -0.341 . . . . 0.57 110.699 178.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 30' ' ' GLU . 12.4 t -67.49 -39.19 85.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.321 -0.399 . . . . 1.29 110.413 179.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.0 m -71.33 -27.27 63.27 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.879 0.371 . . . . 0.78 110.973 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.43 -45.22 10.72 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.188 0.44 . . . . 0.64 112.188 -175.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 86.3 mt -95.63 -21.96 17.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.676 0.274 . . . . 0.94 111.391 -176.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt 56.11 80.42 0.29 Allowed Pre-proline 0 C--N 1.329 -0.317 0 C-N-CA 123.399 0.68 . . . . 3.36 112.116 -178.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -92.92 138.98 1.64 Allowed 'Trans proline' 0 N--CA 1.446 -1.294 0 C-N-CA 122.938 2.425 . . . . 0.63 111.684 171.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 13.5 p -75.7 -26.86 57.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.225 0.536 . . . . 0.73 109.808 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.485 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 88.2 t80 -140.87 137.35 33.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.338 -0.846 . . . . 0.76 109.757 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 48.4 tp -136.27 117.14 14.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.34 -0.391 . . . . 1.55 110.338 178.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.47 ' HB2' ' CE2' ' A' ' 41' ' ' PHE . 40.5 tt0 -112.63 115.23 28.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.161 -0.472 . . . . 2.23 110.502 -178.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -94.28 117.12 29.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 1.72 110.101 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 57.2 t -120.37 127.9 75.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.113 -0.494 . . . . 1.08 111.08 -178.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -75.77 101.36 5.04 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.374 0.607 . . . . 1.83 109.41 172.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.434 ' HE3' ' HB2' ' A' ' 47' ' ' LYS . 20.7 ttmt -101.74 21.67 14.11 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.57 -0.741 . . . . 2.76 110.012 -175.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.54 ' HB3' ' HA2' ' A' ' 52' ' ' GLY . 22.9 t -94.62 134.7 36.92 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.554 -0.748 . . . . 3.2 109.332 175.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.7 p -100.31 8.45 43.7 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.941 0.4 . . . . 4.74 111.068 -178.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -122.82 -107.98 1.91 Allowed Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.498 -0.858 . . . . 3.16 112.723 -178.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 62.4 m -88.5 1.71 54.31 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.078 0.399 . . . . 4.36 112.078 -174.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.54 ' HA2' ' HB3' ' A' ' 48' ' ' SER . . . 80.12 44.69 8.74 Favored Glycine 0 N--CA 1.45 -0.369 0 N-CA-C 110.668 -0.973 . . . . 2.26 110.668 -174.064 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.1 m -87.3 -6.32 58.57 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.08 -0.56 . . . . 3.46 111.554 -172.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.427 ' HA ' ' O ' ' A' ' 89' ' ' ALA . 26.6 p -138.73 137.61 36.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.994 0.426 . . . . 1.71 111.891 -175.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -111.57 135.97 51.42 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.913 -0.585 . . . . 1.15 109.533 174.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -119.27 118.38 31.1 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.449 -0.575 . . . . 1.35 109.449 179.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -109.79 122.77 48.25 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.053 0.454 . . . . 0.51 111.767 -174.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.401 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 61.3 t -91.57 111.64 24.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.746 -0.661 . . . . 0.55 109.265 174.132 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.472 ' CG1' ' HA ' ' A' ' 94' ' ' CYS . 1.4 pp -99.25 138.12 24.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.388 -0.369 . . . . 1.18 110.358 -176.394 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.485 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 66.0 t -124.76 99.76 6.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 108.999 -0.741 . . . . 0.58 108.999 174.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 31.4 t -139.25 148.19 42.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.053 0.454 . . . . 0.84 111.8 -174.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.453 ' ND2' ' HG2' ' A' ' 97' ' ' PRO . 0.9 OUTLIER -67.66 -19.09 65.16 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.537 -0.756 . . . . 1.67 111.033 174.164 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -56.1 -40.0 73.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.817 0.342 . . . . 1.81 111.908 -175.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -94.25 5.24 52.38 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.942 0.349 . . . . 3.19 111.942 -171.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.44 -14.6 60.86 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.873 -0.517 . . . . 2.14 110.318 -178.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.546 ' OD2' ' HG2' ' A' ' 68' ' ' LYS . 23.1 t70 -81.27 -12.54 59.06 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.673 -0.694 . . . . 2.03 109.793 174.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt 67.79 35.96 3.72 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.195 -0.911 . . . . 3.31 110.731 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.892 ' HB3' ' HB2' ' A' ' 71' ' ' ASP . 32.2 mmtm -72.6 95.9 1.9 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.059 -0.519 . . . . 1.99 111.225 177.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.44 ' O ' ' HG3' ' A' ' 72' ' ' ARG . 2.8 tm? -73.71 -47.32 40.36 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.759 -0.46 . . . . 2.33 109.759 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.458 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.28 -32.09 72.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.275 -0.421 . . . . 1.09 111.253 -177.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.892 ' HB2' ' HB3' ' A' ' 68' ' ' LYS . 3.6 m-20 -73.94 -42.52 60.42 Favored 'General case' 0 CA--C 1.52 -0.209 0 C-N-CA 120.976 -0.29 . . . . 2.08 111.285 179.034 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.465 ' HE ' ' C ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -63.91 -28.32 69.75 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 120.128 -0.629 . . . . 2.93 109.589 178.168 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 75.9 t60 -65.36 -58.88 4.79 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.19 -0.459 . . . . 1.21 110.064 176.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.526 ' HD3' ' OD1' ' A' ' 71' ' ' ASP . 5.6 ptm180 -63.91 -41.6 97.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.019 -0.537 . . . . 1.67 111.616 -175.099 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 89.2 mt -66.54 -51.39 57.08 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.631 0.253 . . . . 1.48 110.866 -177.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.863 HG13 HD22 ' A' ' 80' ' ' LEU . 25.3 t -58.49 -44.94 90.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.439 . . . . 0.82 111.171 -179.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.506 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 13.5 m120 -63.61 -43.11 97.86 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.714 -0.394 . . . . 1.14 111.277 -177.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 35.0 m -67.85 -40.99 83.61 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.138 0.422 . . . . 0.69 112.138 -174.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.573 HG22 ' OE2' ' A' ' 83' ' ' GLU . 17.1 mt -90.07 -52.19 10.96 Favored 'Isoleucine or valine' 0 C--O 1.25 1.106 0 CA-C-O 122.011 0.91 . . . . 0.77 110.826 -175.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.863 HD22 HG13 ' A' ' 76' ' ' VAL . 9.7 mp -67.68 -9.85 47.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.352 -0.84 . . . . 0.78 110.477 -179.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.506 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 55.5 tptt -47.07 -56.84 5.81 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 109.592 -0.522 . . . . 1.93 109.592 165.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.581 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 43.7 mt-10 -74.99 -30.56 61.2 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.078 -0.51 . . . . 2.91 111.253 -179.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.595 ' HB2' ' HA ' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -52.56 -56.09 17.69 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 122.353 1.073 . . . . 1.66 110.91 173.764 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.779 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 32.9 mt -50.5 -30.69 13.43 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 112.94 -1.936 . . . . 0.58 112.906 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.581 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 26.1 mm-40 -59.12 -23.63 62.3 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 120.55 -0.46 . . . . 0.92 110.54 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 -102.28 -23.23 14.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.126 -0.488 . . . . 1.02 111.154 -178.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.9 mt -110.3 133.87 54.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.757 0.313 . . . . 0.77 111.03 -174.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 39.1 t60 -72.03 -43.34 65.13 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.853 0.359 . . . . 1.85 110.201 178.108 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.427 ' O ' ' HA ' ' A' ' 54' ' ' SER . . . -145.5 105.03 3.97 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.959 0.409 . . . . 0.78 110.862 178.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -105.37 132.83 51.06 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.0 0.429 . . . . 0.63 110.672 176.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.9 m -123.77 145.96 48.66 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.921 -0.581 . . . . 1.27 109.445 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -132.27 138.65 47.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.299 0.571 . . . . 0.64 111.499 -176.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -109.34 109.22 20.04 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.491 -0.777 . . . . 2.23 109.282 172.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.472 ' HA ' ' CG1' ' A' ' 59' ' ' ILE . 9.0 p -83.34 99.81 10.26 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.967 -0.561 . . . . 1.38 110.336 -176.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.5 m170 -118.45 163.01 17.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.452 0.644 . . . . 1.98 111.423 -178.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.97 156.32 50.26 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 115.275 -0.875 . . . . 0.76 110.732 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.453 ' HG2' ' ND2' ' A' ' 62' ' ' ASN . 35.0 Cg_exo -58.63 -27.88 84.34 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.947 2.431 . . . . 0.72 112.823 -177.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.51 -51.21 70.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.977 0.418 . . . . 2.08 109.999 178.537 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.504 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 11.4 mp0 -65.6 -43.68 88.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.907 -0.588 . . . . 2.69 110.666 178.164 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.415 ' O ' ' HG2' ' A' ' 104' ' ' LYS . 66.9 t80 -59.43 -37.39 77.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.095 -0.502 . . . . 1.46 110.938 -179.326 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -57.9 -34.59 69.99 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.298 0.571 . . . . 1.23 110.503 178.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.639 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -78.89 -44.97 21.59 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.5 -0.773 . . . . 2.66 110.466 176.678 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.633 HD23 ' HA2' ' A' ' 107' ' ' GLY . 86.4 mt -60.37 -44.37 95.67 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.032 -0.531 . . . . 1.31 111.894 -176.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.415 ' HG2' ' O ' ' A' ' 100' ' ' TYR . 4.4 pttp -63.53 -29.64 70.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.021 0.439 . . . . 1.84 111.088 -179.25 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 21.7 t -83.13 -49.01 9.93 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.123 0.487 . . . . 2.05 109.916 -178.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -153.17 -44.38 0.1 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.655 -0.702 . . . . 4.02 111.406 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.633 ' HA2' HD23 ' A' ' 103' ' ' LEU . . . 93.95 28.18 11.38 Favored Glycine 0 C--N 1.318 -0.423 0 N-CA-C 111.275 -0.73 . . . . 3.92 111.275 -176.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 8.4 t . . . . . 0 C--O 1.252 1.208 0 CA-C-O 118.621 -0.705 . . . . 4.98 109.266 -176.74 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.8 ptp . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 110.355 -0.239 . . . . 36.14 110.355 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 140.27 -170.97 24.15 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.925 -0.655 . . . . 33.7 112.021 179.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 69.6 m -87.9 156.22 19.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.853 0.359 . . . . 32.35 110.496 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 7.5 t -81.61 72.37 8.65 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.334 0.588 . . . . 30.38 110.079 -178.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 25.5 m170 -129.25 27.32 5.36 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.654 -0.703 . . . . 28.39 110.591 178.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -81.58 30.68 0.35 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.168 -0.469 . . . . 28.54 111.539 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -84.77 89.92 7.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.317 -0.401 . . . . 26.47 110.35 -178.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 14.6 p-80 -129.69 139.71 51.29 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.156 -0.475 . . . . 24.34 110.14 177.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 30.8 t60 -108.48 120.95 43.9 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.108 -0.496 . . . . 23.8 110.946 -173.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.2 t-160 -97.04 95.84 8.07 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.079 -0.711 . . . . 20.9 109.079 176.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.4 p -83.3 -60.41 2.15 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.03 -0.532 . . . . 19.89 112.231 -174.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.2 t -81.28 108.64 15.08 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.941 0.4 . . . . 17.26 110.995 -177.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -151.67 10.61 0.7 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.933 -0.651 . . . . 16.67 112.373 176.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -98.74 -26.04 14.47 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.006 0.432 . . . . 19.13 110.957 -177.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -120.5 22.95 11.07 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.211 -0.45 . . . . 14.57 111.774 -170.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -75.24 -1.16 22.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.39 -0.368 . . . . 15.4 110.876 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 82.4 mt -82.95 -18.02 41.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.139 -0.482 . . . . 16.35 110.564 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -101.44 110.07 22.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.048 -0.524 . . . . 15.41 110.22 -178.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.613 ' HA ' ' NE2' ' A' ' 22' ' ' HIS . 53.8 p90 -67.58 -24.38 65.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.988 -0.551 . . . . 11.39 110.879 -177.535 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -59.87 -23.83 63.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.617 -0.719 . . . . 10.77 112.006 -176.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -96.52 18.94 56.58 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.777 -0.725 . . . . 6.73 113.389 -175.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.613 ' NE2' ' HA ' ' A' ' 19' ' ' PHE . 29.0 p80 -159.06 64.37 0.41 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.397 0.618 . . . . 6.08 111.216 177.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 88.4 mmm -88.56 -10.18 49.69 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.079 -0.509 . . . . 4.41 110.876 -177.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 67.8 m -89.92 88.75 7.44 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.15 0.5 . . . . 1.71 111.236 -179.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 11.9 tt -67.15 -35.87 75.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.914 -0.584 . . . . 1.37 111.325 -177.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -62.12 -36.62 82.31 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 120.743 -0.383 . . . . 1.75 110.128 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.408 ' HD3' ' HB2' ' A' ' 31' ' ' ASP . 15.7 tppt? -65.63 -44.66 85.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.382 -0.372 . . . . 2.5 110.489 178.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.0 t -54.59 -54.31 23.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 CA-C-O 120.865 0.364 . . . . 1.04 110.93 178.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.438 HG13 ' OE1' ' A' ' 83' ' ' GLU . 1.8 mp -61.88 -54.64 31.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.029 -0.532 . . . . 0.79 110.992 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -55.41 -52.44 63.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.025 -0.534 . . . . 2.2 111.801 -174.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.408 ' HB2' ' HD3' ' A' ' 27' ' ' LYS . 0.7 OUTLIER -75.04 -28.54 60.46 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.675 -0.41 . . . . 1.67 111.381 -170.613 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.1 ttpm? -67.95 -48.13 66.74 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.615 -0.434 . . . . 2.03 110.665 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.405 HD12 ' N ' ' A' ' 34' ' ' SER . 4.4 pp -72.99 -29.64 63.2 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.781 -0.368 . . . . 0.57 110.944 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.405 ' N ' HD12 ' A' ' 33' ' ' LEU . 66.0 m -70.44 -34.8 72.88 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 116.574 -0.284 . . . . 1.29 111.058 178.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 56.4 m -71.59 -27.4 63.1 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.786 0.327 . . . . 0.78 111.2 177.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.7 -49.68 15.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.282 -0.417 . . . . 0.64 111.739 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 91.0 mt -84.15 -31.66 25.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.859 0.361 . . . . 0.94 110.401 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.471 ' HA ' ' HD2' ' A' ' 38' ' ' LYS . 41.5 tptt 55.57 88.46 0.12 Allowed Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 114.959 -1.019 . . . . 3.36 111.695 -176.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.897 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 97.4 Cg_endo -89.18 137.87 3.21 Favored 'Trans proline' 0 N--CA 1.451 -0.997 0 C-N-CA 122.743 2.295 . . . . 0.63 112.606 179.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.4 p -69.91 -29.85 67.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.452 0.644 . . . . 0.73 109.735 173.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.779 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 90.8 t80 -140.74 127.94 20.96 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.173 -0.921 . . . . 0.76 109.112 175.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.415 HD22 ' HA ' ' A' ' 42' ' ' LEU . 1.2 tm? -136.28 126.05 25.62 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.518 -0.549 . . . . 1.55 109.518 -178.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -129.64 127.84 41.41 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.735 -0.468 . . . . 2.23 109.735 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -94.99 115.75 27.83 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.78 -0.452 . . . . 1.72 109.78 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 60.8 t -103.44 121.76 55.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-N 116.041 -0.527 . . . . 1.08 110.395 -177.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -68.48 111.15 4.52 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.981 -0.554 . . . . 1.83 109.667 177.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.715 ' HD3' ' HB2' ' A' ' 56' ' ' ASP . 18.5 tptt -81.08 117.39 21.62 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 108.883 -0.784 . . . . 2.76 108.883 179.641 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.6 t -59.9 114.27 2.72 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.598 -0.728 . . . . 3.2 112.063 -169.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 25.4 p -162.19 154.01 18.74 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.438 -0.801 . . . . 4.74 109.356 173.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -73.83 -66.06 2.07 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.863 -0.684 . . . . 3.16 113.385 -175.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 11.9 p -120.58 14.07 11.79 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.187 0.518 . . . . 4.36 110.757 -176.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -76.74 -41.14 24.61 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.752 -0.737 . . . . 2.26 112.454 -178.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 28.6 m 60.36 82.59 0.16 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.412 0.625 . . . . 3.46 110.41 -176.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.426 ' OG ' ' HB3' ' A' ' 47' ' ' LYS . 12.3 p -129.27 140.75 51.32 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.795 -0.639 . . . . 1.71 110.963 -177.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -127.4 133.53 49.99 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.323 -0.398 . . . . 1.15 110.818 -178.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.715 ' HB2' ' HD3' ' A' ' 47' ' ' LYS . 27.7 t0 -112.34 115.67 29.13 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.697 -0.853 . . . . 1.35 108.697 177.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.85 119.53 39.39 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.208 0.528 . . . . 0.51 111.738 -171.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 48.4 t -84.27 111.32 19.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.646 -0.706 . . . . 0.55 109.33 176.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.499 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -107.52 109.29 27.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.712 0.767 . . . . 1.18 110.45 -176.818 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.779 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 97.3 t -106.88 108.66 25.72 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 114.929 -1.032 . . . . 0.58 109.024 175.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.897 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 31.2 t -153.38 155.08 35.74 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.064 0.459 . . . . 0.84 111.935 -172.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.551 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 14.0 m120 -62.55 -19.44 63.67 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.409 -0.814 . . . . 1.67 110.476 173.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -49.73 -46.62 50.52 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.775 -0.648 . . . . 1.81 111.307 176.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -94.17 2.5 55.94 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.898 -0.592 . . . . 3.19 110.812 -175.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.551 ' HB3' ' HA ' ' A' ' 62' ' ' ASN . 0.2 OUTLIER -85.25 -24.58 27.72 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-O 121.4 0.619 . . . . 2.14 109.527 -176.51 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -77.2 1.38 18.6 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.739 -0.664 . . . . 2.03 110.496 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 87.3 mttt 68.8 11.05 8.22 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.344 -0.844 . . . . 3.31 112.7 175.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.6 mmmm -84.51 89.43 7.43 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.155 -0.618 . . . . 1.99 110.229 -178.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.509 HD12 ' N ' ' A' ' 70' ' ' LEU . 3.3 pp -73.77 -34.25 64.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.033 -0.531 . . . . 2.33 111.082 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.509 ' N ' HD12 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -68.0 -33.88 75.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.336 -0.393 . . . . 1.09 111.036 178.387 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.676 ' O ' ' HG2' ' A' ' 74' ' ' ARG . 27.3 m-20 -74.03 -46.17 45.08 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.169 -0.213 . . . . 2.08 111.153 -178.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.48 ' HG2' ' HA ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -61.07 -34.51 75.01 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.21 -0.596 . . . . 2.93 109.918 176.84 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -64.44 -50.67 66.66 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.275 -0.421 . . . . 1.21 110.163 179.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.676 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 4.4 ptm180 -66.15 -36.25 82.62 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.218 -0.446 . . . . 1.67 110.944 -177.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 92.4 mt -66.94 -53.32 32.97 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.712 0.292 . . . . 1.48 110.659 178.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.633 HG13 HD22 ' A' ' 80' ' ' LEU . 54.9 t -58.18 -44.18 87.19 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 CA-C-N 116.029 -0.532 . . . . 0.82 110.895 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.555 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -62.3 -42.03 99.01 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.637 0.236 . . . . 1.14 111.637 -178.655 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 47.2 m -69.15 -48.91 61.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.923 0.392 . . . . 0.69 111.577 -175.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 39.6 mt -75.49 -50.76 22.85 Favored 'Isoleucine or valine' 0 C--O 1.239 0.549 0 CA-C-O 121.522 0.677 . . . . 0.77 110.663 -177.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.9 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 9.6 mp -76.61 -5.36 47.42 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-N 115.631 -0.713 . . . . 0.78 111.377 -175.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.555 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 18.7 tppt? -52.39 -63.63 1.08 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.559 -0.534 . . . . 1.93 109.559 172.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -75.36 -30.71 60.29 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.758 -0.655 . . . . 2.91 110.963 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.9 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 5.0 tp10 -55.96 -54.36 45.68 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.003 0.43 . . . . 1.66 111.539 178.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.775 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 68.7 mt -50.69 -30.42 13.69 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-N 115.388 -0.824 . . . . 0.58 112.494 -178.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 -54.54 -28.29 44.51 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.629 0.252 . . . . 0.92 111.362 -176.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -92.35 0.81 57.47 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.031 0.443 . . . . 1.02 110.951 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.522 HG21 ' HB2' ' A' ' 90' ' ' PHE . 9.5 mt -121.73 143.21 35.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.121 -0.491 . . . . 0.77 109.847 -177.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 37.3 t60 -77.85 -46.06 22.51 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.699 -0.482 . . . . 1.85 109.699 176.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -153.77 102.74 2.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.07 -0.514 . . . . 0.78 110.982 178.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . 0.522 ' HB2' HG21 ' A' ' 87' ' ' ILE . 83.2 t80 -102.33 131.84 48.69 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.278 -0.419 . . . . 0.63 110.24 175.523 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 31.6 t -122.37 157.53 31.62 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.502 -0.555 . . . . 1.27 109.502 178.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -144.43 139.96 28.69 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.078 0.466 . . . . 0.64 110.958 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 26.5 mmtp -121.22 109.13 14.59 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.66 -0.7 . . . . 2.23 109.143 177.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.49 ' HA ' HG23 ' A' ' 59' ' ' ILE . 7.4 p -98.79 131.04 45.22 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.167 0.508 . . . . 1.38 112.23 -172.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.419 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 1.5 m170 -148.75 175.52 11.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.599 -0.728 . . . . 1.98 110.223 174.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.405 ' HB ' ' HD2' ' A' ' 97' ' ' PRO . 74.9 p -103.25 159.24 29.9 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.293 -0.412 . . . . 0.76 111.229 -175.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.405 ' HD2' ' HB ' ' A' ' 96' ' ' THR . 20.4 Cg_endo -61.81 -26.41 79.44 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.634 2.222 . . . . 0.72 111.667 176.495 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.65 -48.94 75.19 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.417 -0.586 . . . . 2.08 109.417 178.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.554 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 11.4 mm-40 -61.24 -49.61 76.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.671 -0.695 . . . . 2.69 110.597 177.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.557 ' O ' ' HG2' ' A' ' 104' ' ' LYS . 84.5 t80 -59.57 -42.88 93.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.856 -0.611 . . . . 1.46 110.882 -178.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -61.48 -37.69 84.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 1.23 110.842 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.801 ' HA ' ' HE3' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -65.18 -38.35 90.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.412 -0.358 . . . . 2.66 110.998 177.247 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 54.3 mt -66.04 -49.96 65.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.041 -0.527 . . . . 1.31 110.67 -179.482 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.557 ' HG2' ' O ' ' A' ' 100' ' ' TYR . 16.8 ptmt -70.86 -29.63 65.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.158 -0.473 . . . . 1.84 111.582 -178.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 25.2 t -60.0 -55.9 28.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.948 0.404 . . . . 2.05 111.167 -177.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.54 -56.54 1.88 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.425 -0.352 . . . . 4.02 111.84 -176.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 129.95 53.0 0.1 Allowed Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.704 -0.76 . . . . 3.92 111.941 -176.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 5.0 p . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.469 -0.777 . . . . 4.98 110.179 177.073 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.475 ' H3 ' ' CD ' ' A' ' 30' ' ' GLU . 96.0 mmm . . . . . 0 N--CA 1.481 1.108 0 N-CA-C 110.184 -0.302 . . . . 36.14 110.184 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 92.09 154.78 31.22 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.871 -0.681 . . . . 33.7 111.772 -177.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 25.4 t -87.84 110.44 20.5 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.609 -0.515 . . . . 32.35 109.609 178.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.515 ' OG ' ' HD2' ' A' ' 39' ' ' PRO . 3.6 m -55.28 114.24 1.72 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.759 -0.655 . . . . 30.38 112.54 -174.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 70.7 m80 -139.2 90.96 2.47 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.91 -0.774 . . . . 28.39 108.91 174.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 58.2 t60 -108.65 98.27 7.81 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.257 0.551 . . . . 28.54 112.386 -169.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 19.8 m80 -125.14 79.44 1.8 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.741 -0.837 . . . . 26.47 108.741 167.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 69.43 -46.84 0.58 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 114.925 -1.034 . . . . 24.34 110.858 -171.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 77.8 t60 -65.78 144.33 56.94 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.186 -0.461 . . . . 23.8 110.162 177.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 66.2 m-70 -81.8 -179.97 7.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.294 -0.412 . . . . 20.9 110.363 177.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.6 m -96.49 20.54 10.48 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.767 0.794 . . . . 19.89 109.461 178.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.7 m -114.99 158.18 22.41 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.983 -1.008 . . . . 17.26 110.751 -177.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 142.0 40.08 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.732 -0.746 . . . . 16.67 112.098 -179.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 53.9 mtm180 -112.75 -35.98 5.32 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.699 0.761 . . . . 19.13 109.733 -179.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.502 ' HB2' ' HB2' ' A' ' 20' ' ' GLN . 1.6 pm0 -86.29 17.34 3.76 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.861 -1.063 . . . . 14.57 111.485 -176.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -80.41 -12.36 59.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.117 0.484 . . . . 15.4 109.883 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 55.0 mt -75.33 -26.62 58.77 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.492 -0.776 . . . . 16.35 110.624 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.479 ' HB2' ' HG2' ' A' ' 20' ' ' GLN . 93.6 m-85 -115.48 178.03 4.45 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.696 -0.684 . . . . 15.41 110.548 -176.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.0 p90 -79.93 16.19 1.25 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.115 -0.493 . . . . 11.39 110.816 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.502 ' HB2' ' HB2' ' A' ' 15' ' ' GLU . 32.5 mm-40 -55.91 -78.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.768 -0.651 . . . . 10.77 112.016 -176.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 52.62 33.32 41.13 Favored Glycine 0 CA--C 1.52 0.368 0 C-N-CA 120.988 -0.625 . . . . 6.73 112.018 -175.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -77.74 82.73 4.12 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.449 0.643 . . . . 6.08 112.029 -174.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 73.2 mtm -89.26 56.08 3.52 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.997 -0.547 . . . . 4.41 109.774 175.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.468 ' O ' HG23 ' A' ' 28' ' ' VAL . 41.1 t -68.73 152.17 45.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.645 -0.707 . . . . 1.71 110.032 178.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 10.3 tp -54.08 -31.15 21.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.045 -0.525 . . . . 1.37 111.244 -178.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -59.38 -52.35 65.99 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.033 -0.53 . . . . 1.75 110.449 177.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -71.92 -29.64 64.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.818 -0.628 . . . . 2.5 111.116 -177.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 24' ' ' CYS . 87.1 t -56.94 -50.21 76.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.838 0.351 . . . . 1.04 110.392 177.397 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.699 HG23 ' HG3' ' A' ' 83' ' ' GLU . 1.7 mp -66.68 -39.85 84.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.972 -0.558 . . . . 0.79 110.546 177.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.475 ' CD ' ' H3 ' ' A' ' 1' ' ' MET . 1.1 tm-20 -59.14 -52.19 66.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.95 -0.568 . . . . 2.2 110.89 -177.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -67.24 -36.55 81.88 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.108 0.48 . . . . 1.67 110.494 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 53.4 tttm -64.46 -52.57 57.32 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.592 -0.731 . . . . 2.03 111.592 -176.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.435 HD12 ' N ' ' A' ' 34' ' ' SER . 4.6 pp -71.51 -28.45 63.91 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.753 -0.379 . . . . 0.57 110.549 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.435 ' N ' HD12 ' A' ' 33' ' ' LEU . 39.4 t -63.74 -45.2 90.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.094 0.473 . . . . 1.29 110.024 177.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.0 m -62.16 -27.41 68.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.789 -0.641 . . . . 0.78 111.926 -178.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -93.35 -54.67 3.59 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.031 0.382 . . . . 0.64 112.031 -177.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 96.5 mt -72.47 -30.83 64.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.373 -0.376 . . . . 0.94 111.335 -175.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm 61.12 68.07 1.31 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.871 -0.604 . . . . 3.36 111.45 -178.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.515 ' HD2' ' OG ' ' A' ' 4' ' ' SER . 72.6 Cg_endo -90.32 126.92 1.36 Allowed 'Trans proline' 0 N--CA 1.447 -1.245 0 C-N-CA 122.549 2.166 . . . . 0.63 111.824 173.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.9 p -64.53 -26.36 68.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.301 0.572 . . . . 0.73 110.191 177.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.541 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 77.9 t80 -141.78 140.22 32.98 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.373 -0.83 . . . . 0.76 109.319 173.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -142.15 108.76 5.35 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.898 -0.778 . . . . 1.55 108.898 179.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.554 ' HB3' ' HB ' ' A' ' 58' ' ' VAL . 27.1 tt0 -100.14 140.36 34.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.402 -0.363 . . . . 2.23 110.104 -178.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -107.45 120.39 42.05 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.09 0.472 . . . . 1.72 110.862 -179.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 40.8 t -109.85 125.56 67.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 108.864 -0.791 . . . . 1.08 108.864 172.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -69.92 113.52 7.22 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.002 0.429 . . . . 1.83 109.908 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.432 ' O ' ' HB2' ' A' ' 54' ' ' SER . 0.7 OUTLIER -91.85 78.94 5.35 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.109 -0.496 . . . . 2.76 110.394 -176.368 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 38.6 m -68.94 90.45 0.44 Allowed 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.56 -0.533 . . . . 3.2 109.56 174.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 9.6 t -99.4 3.1 45.73 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.991 -0.55 . . . . 4.74 110.414 -176.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 79.92 -51.15 4.03 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.99 -0.624 . . . . 3.16 113.055 175.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 34.2 m -54.9 -57.78 10.24 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 122.414 0.286 . . . . 4.36 110.955 -178.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -164.96 -177.11 37.24 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 121.008 -0.615 . . . . 2.26 111.592 -179.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.3 t -56.94 122.26 11.86 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.713 0.768 . . . . 3.46 111.121 -178.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.432 ' HB2' ' O ' ' A' ' 47' ' ' LYS . 14.6 m -142.09 151.83 42.71 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.517 -0.765 . . . . 1.71 109.808 -178.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -135.14 141.37 45.95 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.654 -0.248 . . . . 1.15 110.502 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.68 108.44 17.49 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.455 -0.943 . . . . 1.35 108.455 174.492 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.78 118.54 36.84 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.996 0.427 . . . . 0.51 111.525 -173.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.554 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 32.2 t -83.59 112.5 21.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.538 -0.541 . . . . 0.55 109.538 177.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.507 HG12 ' HA ' ' A' ' 94' ' ' CYS . 2.8 pt -96.87 145.29 9.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.178 0.513 . . . . 1.18 110.675 -177.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.541 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 60.8 t -137.86 97.56 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 N-CA-C 108.028 -1.101 . . . . 0.58 108.028 174.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.445 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 40.8 t -144.61 150.66 37.81 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.04 0.756 . . . . 0.84 113.04 -170.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.689 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 1.0 OUTLIER -67.22 -19.19 65.5 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 114.818 -1.083 . . . . 1.67 110.886 172.939 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -55.55 -32.93 63.38 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.291 0.478 . . . . 1.81 112.291 -172.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -104.35 -3.07 24.62 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.191 0.441 . . . . 3.19 112.191 -173.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.689 ' HG2' ' O ' ' A' ' 62' ' ' ASN . 9.6 pt-20 -76.73 0.4 20.61 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.906 -0.496 . . . . 2.14 111.15 -177.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.445 ' OD2' ' HG3' ' A' ' 68' ' ' LYS . 26.6 t70 -88.98 -8.71 53.59 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.064 0.459 . . . . 2.03 110.061 177.146 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt 77.32 -13.82 0.91 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 115.244 -0.889 . . . . 3.31 112.887 174.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.445 ' HG3' ' OD2' ' A' ' 66' ' ' ASP . 29.9 mtmm -72.28 111.85 7.85 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.961 0.41 . . . . 1.99 110.971 176.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.4 pp -73.87 -31.41 63.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.796 -0.638 . . . . 2.33 111.738 -176.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.429 HD22 ' C ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -65.9 -31.1 71.85 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.677 -0.409 . . . . 1.09 111.335 -175.002 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.545 ' O ' ' HG2' ' A' ' 74' ' ' ARG . 1.5 t70 -73.88 -37.13 64.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.248 0.547 . . . . 2.08 109.969 -178.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.3 tmm_? -63.66 -44.14 94.66 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.967 -0.753 . . . . 2.93 108.967 174.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 21.1 t60 -61.48 -50.25 73.51 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.243 -0.889 . . . . 1.21 111.272 -178.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.545 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 9.3 ptm180 -62.0 -38.6 89.26 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.5 -0.318 . . . . 1.67 111.192 -177.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -67.4 -54.18 22.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.973 0.416 . . . . 1.48 110.633 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.86 HG13 HD22 ' A' ' 80' ' ' LEU . 65.2 t -58.86 -48.67 85.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.062 -0.517 . . . . 0.82 111.237 -177.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.497 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -59.37 -48.23 82.42 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 121.161 -0.216 . . . . 1.14 111.464 -177.176 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 58.7 m -62.45 -54.77 35.23 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.813 0.671 . . . . 0.69 112.813 -173.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.639 HG22 ' OE2' ' A' ' 83' ' ' GLU . 5.1 mp -85.08 -48.38 16.44 Favored 'Isoleucine or valine' 0 C--O 1.247 0.947 0 CA-C-O 121.545 0.688 . . . . 0.77 111.103 -174.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.86 HD22 HG13 ' A' ' 76' ' ' VAL . 8.1 mp -68.51 -10.32 54.85 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.972 -0.558 . . . . 0.78 110.752 -177.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.497 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 20.7 tptm -52.01 -58.44 6.52 Favored 'General case' 0 C--N 1.333 -0.112 0 N-CA-C 109.493 -0.558 . . . . 1.93 109.493 165.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.572 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 39.5 mt-10 -60.8 -36.43 79.02 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.331 -0.85 . . . . 2.91 110.72 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.699 ' HG3' HG23 ' A' ' 29' ' ' ILE . 0.0 OUTLIER -52.76 -55.6 21.69 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 122.178 0.99 . . . . 1.66 110.381 173.254 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.757 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 54.6 mt -50.25 -30.6 12.09 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 113.061 -1.881 . . . . 0.58 112.691 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.572 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 20.7 mm-40 -61.64 -25.6 67.47 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 120.909 0.385 . . . . 0.92 110.736 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -98.35 -29.85 12.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.003 -0.544 . . . . 1.02 111.133 -176.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.488 HD12 ' HB2' ' A' ' 90' ' ' PHE . 2.7 mt -94.95 170.86 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 109.649 -0.5 . . . . 0.77 109.649 -178.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -94.63 -59.34 1.95 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.199 -0.667 . . . . 1.85 109.199 169.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -133.71 111.27 10.43 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.765 -0.652 . . . . 0.78 110.312 178.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . 0.488 ' HB2' HD12 ' A' ' 87' ' ' ILE . 90.2 t80 -95.21 122.51 37.97 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.112 0.482 . . . . 0.63 110.278 177.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 41.6 t -111.07 151.71 27.75 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.721 -0.672 . . . . 1.27 109.381 178.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -140.27 145.29 37.11 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.913 0.387 . . . . 0.64 110.849 -177.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.5 ' HG3' HG22 ' A' ' 58' ' ' VAL . 61.9 mmtt -105.89 113.87 27.68 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.325 -0.991 . . . . 2.23 108.325 173.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.507 ' HA ' HG12 ' A' ' 59' ' ' ILE . 5.5 p -83.39 110.35 18.08 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.093 0.473 . . . . 1.38 111.087 -176.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -135.86 160.29 39.04 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.433 0.635 . . . . 1.98 111.254 178.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.4 p -120.23 156.45 54.99 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.398 -0.819 . . . . 0.76 110.724 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -56.52 -52.12 7.71 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 123.259 2.639 . . . . 0.72 114.393 -170.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -61.19 -47.37 86.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.79 0.328 . . . . 2.08 111.398 -173.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 53.6 mp0 -68.14 -42.67 79.76 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.163 -0.471 . . . . 2.69 111.105 -178.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -63.95 -33.42 75.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 1.46 111.498 -176.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -62.8 -33.14 74.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.96 0.41 . . . . 1.23 111.147 -178.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.668 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -75.17 -20.63 59.24 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.438 -0.346 . . . . 2.66 110.684 179.478 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 83.5 mt -74.83 -53.04 9.83 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.84 -0.43 . . . . 1.31 109.84 175.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 7.6 ptmt -68.64 -8.31 41.07 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.875 -0.602 . . . . 1.84 111.472 179.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 47.8 t -56.81 -33.75 67.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.029 -0.532 . . . . 2.05 110.824 177.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.403 ' HG2' ' N ' ' A' ' 107' ' ' GLY . 0.0 OUTLIER -132.92 -45.99 0.86 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.034 0.445 . . . . 4.02 110.7 177.83 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.403 ' N ' ' HG2' ' A' ' 106' ' ' LYS . . . 153.86 -42.63 0.62 Allowed Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 111.386 -0.686 . . . . 3.92 111.386 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.449 -0.786 . . . . 4.98 109.302 177.675 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.4 mtt . . . . . 0 N--CA 1.481 1.105 0 CA-C-O 120.731 0.301 . . . . 36.14 110.382 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 141.33 -170.05 24.83 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 111.296 -0.721 . . . . 33.7 111.296 -178.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 70.4 m -71.84 -52.24 18.43 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.955 0.378 . . . . 32.35 110.589 176.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 44.7 t -177.84 111.92 0.07 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.964 -0.562 . . . . 30.38 109.498 178.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.414 ' N ' ' HB3' ' A' ' 46' ' ' ASP . 78.6 m-70 -79.63 95.61 5.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.307 0.575 . . . . 28.39 111.267 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 45.0 m80 -84.92 110.21 18.7 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.744 -0.836 . . . . 28.54 108.744 175.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.3 p-80 -125.96 93.69 3.9 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.703 0.763 . . . . 26.47 111.259 -179.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 27.5 p80 -87.17 144.94 26.61 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.457 -0.792 . . . . 24.34 110.175 178.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 29.8 p-80 -159.32 176.22 12.42 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.135 -0.484 . . . . 23.8 110.195 -178.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -81.1 154.64 26.68 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.2 -0.667 . . . . 20.9 109.2 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.4 p -62.11 137.79 58.3 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.878 0.37 . . . . 19.89 111.495 -176.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.9 m -70.53 93.39 0.9 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.421 0.629 . . . . 17.26 110.678 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -137.66 44.12 1.15 Allowed Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 111.032 -0.827 . . . . 16.67 111.032 177.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' A' ' 14' ' ' ARG . 11.3 ptm180 -129.41 -44.02 1.26 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.471 -0.364 . . . . 19.13 111.245 -177.227 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -102.97 4.77 37.79 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.218 0.532 . . . . 14.57 109.971 178.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.545 ' HB2' ' OG ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -59.32 -7.43 1.29 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 114.877 -1.056 . . . . 15.4 112.987 179.668 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.503 HD12 ' ND2' ' A' ' 16' ' ' ASN . 5.8 mp -82.08 -13.44 57.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.089 0.471 . . . . 16.35 110.203 175.465 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -123.93 98.05 5.63 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.133 -0.485 . . . . 15.41 110.173 -175.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -73.79 7.86 2.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.077 -0.51 . . . . 11.39 111.507 -176.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -89.32 16.37 7.55 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.076 -0.511 . . . . 10.77 111.037 178.164 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.7 65.22 2.16 Favored Glycine 0 C--N 1.332 0.341 0 CA-C-N 116.157 -0.474 . . . . 6.73 113.045 -176.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -83.32 28.77 0.52 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.233 0.54 . . . . 6.08 110.493 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 49.1 ttm -55.95 -38.76 70.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.129 -0.941 . . . . 4.41 110.609 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.447 ' O ' HG23 ' A' ' 28' ' ' VAL . 43.0 t -163.78 146.48 9.66 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.916 -0.772 . . . . 1.71 108.916 177.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.408 ' O ' HD13 ' A' ' 29' ' ' ILE . 7.2 tp -55.85 -43.93 76.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 120.624 0.249 . . . . 1.37 110.872 178.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -66.06 -35.68 81.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.97 0.414 . . . . 1.75 110.412 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -61.8 -39.32 91.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.819 -0.628 . . . . 2.5 110.432 179.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 24' ' ' CYS . 65.3 t -60.82 -49.5 84.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.91 -0.586 . . . . 1.04 110.254 178.164 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.442 HG13 ' CD ' ' A' ' 83' ' ' GLU . 1.7 mp -57.4 -49.75 79.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 116.089 -0.505 . . . . 0.79 110.62 178.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 81.9 mt-10 -58.77 -51.97 67.69 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.231 -0.441 . . . . 2.2 112.099 -176.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.425 ' OD1' ' HA ' ' A' ' 16' ' ' ASN . 16.1 t70 -70.16 -34.1 72.58 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.804 0.335 . . . . 1.67 110.815 -174.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.404 ' HD2' ' OE2' ' A' ' 83' ' ' GLU . 37.6 ttmt -61.82 -48.86 78.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.269 -0.423 . . . . 2.03 110.934 -178.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.6 pp -73.51 -26.22 60.79 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.887 -0.325 . . . . 0.57 110.629 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.432 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 67.0 m -72.37 -34.56 68.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.508 -0.314 . . . . 1.29 110.628 178.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.545 ' OG ' ' HB2' ' A' ' 16' ' ' ASN . 67.2 m -67.16 -27.43 67.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.15 0.5 . . . . 0.78 111.021 176.326 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.34 -54.82 3.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.095 -0.502 . . . . 0.64 111.843 -176.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.427 HD11 HG22 ' A' ' 76' ' ' VAL . 80.1 mt -84.06 -29.71 26.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.469 -0.332 . . . . 0.94 111.023 -175.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.3 tptm 55.84 78.38 0.38 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 115.454 -0.794 . . . . 3.36 111.216 -176.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.495 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 83.6 Cg_endo -87.97 173.56 4.95 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 122.67 2.247 . . . . 0.63 112.45 178.349 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.9 p -106.66 -27.61 10.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.141 0.496 . . . . 0.73 110.287 175.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.51 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 86.2 t80 -136.63 138.57 41.3 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.825 -0.625 . . . . 0.76 109.886 177.067 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 41.5 tp -142.21 116.45 9.5 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.255 -0.43 . . . . 1.55 110.418 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -125.58 109.53 12.76 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.4 -0.364 . . . . 2.23 110.674 178.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.671 ' HG ' ' HB2' ' A' ' 57' ' ' ALA . 9.1 mp -94.87 123.58 38.42 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.394 -0.595 . . . . 1.72 109.394 173.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 86.1 t -103.33 133.2 47.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 115.974 -0.557 . . . . 1.08 110.489 -176.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.414 ' HB3' ' N ' ' A' ' 5' ' ' HIS . 3.3 t0 -64.11 110.08 2.05 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.711 -0.677 . . . . 1.83 109.595 174.491 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.915 ' HD2' ' HB2' ' A' ' 56' ' ' ASP . 79.3 tttt -112.64 48.24 1.02 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.105 -0.952 . . . . 2.76 109.706 -173.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 72.6 m -67.01 83.88 0.12 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.688 -0.687 . . . . 3.2 111.063 177.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 20.1 t -79.35 94.19 5.46 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.296 -0.631 . . . . 4.74 109.296 178.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 70.28 -114.27 5.37 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.774 -0.727 . . . . 3.16 111.379 -173.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 66.8 m -113.8 107.48 15.78 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.256 -0.276 . . . . 4.36 110.256 179.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 160.29 137.26 2.18 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.896 -0.668 . . . . 2.26 112.204 179.44 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 13.7 m -83.77 99.02 10.02 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.037 0.446 . . . . 3.46 110.759 179.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.504 ' HB3' ' HB3' ' A' ' 89' ' ' ALA . 1.7 p -134.98 151.03 50.46 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.143 -0.48 . . . . 1.71 110.696 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -134.53 144.38 47.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.939 0.399 . . . . 1.15 111.372 -177.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.915 ' HB2' ' HD2' ' A' ' 47' ' ' LYS . 5.5 t70 -115.88 114.15 24.3 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.386 -0.968 . . . . 1.35 108.386 174.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.671 ' HB2' ' HG ' ' A' ' 44' ' ' LEU . . . -110.63 126.54 54.59 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.436 0.532 . . . . 0.51 112.436 -171.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.4 t -93.08 119.84 41.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.601 -0.727 . . . . 0.55 109.67 175.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.465 HD11 ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER -109.87 122.24 64.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 121.244 0.545 . . . . 1.18 110.471 -178.56 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.51 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 89.8 t -114.45 107.82 23.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.596 -0.729 . . . . 0.58 109.92 178.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.495 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 30.5 t -151.02 154.93 37.98 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.948 0.404 . . . . 0.84 111.693 -174.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.5 ' ND2' ' HG2' ' A' ' 97' ' ' PRO . 1.0 OUTLIER -67.25 -18.86 65.4 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.744 -0.662 . . . . 1.67 110.569 173.992 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -53.31 -24.19 11.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.258 -0.428 . . . . 1.81 111.892 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -103.23 -8.31 20.49 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 111.994 0.368 . . . . 3.19 111.994 -177.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.413 ' HB3' HG21 ' A' ' 96' ' ' THR . 0.0 OUTLIER -72.91 -14.31 61.44 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.96 -0.463 . . . . 2.14 110.988 -174.693 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -78.36 0.57 25.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.104 -0.498 . . . . 2.03 110.545 -176.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 84.9 tttt 71.73 2.09 4.15 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.705 -0.679 . . . . 3.31 111.174 176.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -80.28 89.62 5.51 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.046 0.45 . . . . 1.99 110.272 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.8 tt -70.91 -49.03 50.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.857 -0.611 . . . . 2.33 109.732 -179.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.515 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -60.85 -33.25 72.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.85 -0.613 . . . . 1.09 111.628 -179.557 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.515 ' N ' HD22 ' A' ' 70' ' ' LEU . 35.8 t70 -74.07 -48.06 32.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.931 0.396 . . . . 2.08 110.293 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.15 -36.28 74.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.243 0.544 . . . . 2.93 109.636 176.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 48.8 t60 -64.21 -54.8 27.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.505 -0.77 . . . . 1.21 110.774 178.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.438 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 15.5 ptm180 -64.98 -40.39 94.91 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.004 0.372 . . . . 1.67 112.004 -175.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 60.2 mt -60.22 -53.34 58.91 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.922 0.392 . . . . 1.48 110.787 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.427 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 78.6 t -61.17 -43.59 96.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.922 -0.581 . . . . 0.82 110.626 179.589 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.502 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -64.17 -35.88 82.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.279 -0.418 . . . . 1.14 112.078 -177.365 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 88.6 m -71.92 -44.39 63.72 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.775 0.322 . . . . 0.69 111.335 -176.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 50.1 mt -76.84 -50.86 20.21 Favored 'Isoleucine or valine' 0 C--O 1.244 0.811 0 CA-C-O 121.769 0.795 . . . . 0.77 110.612 -178.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.775 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 10.5 mp -74.14 -9.29 58.47 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.356 -0.838 . . . . 0.78 111.418 -176.38 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 16.2 tttm -53.88 -61.93 1.98 Allowed 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 109.778 -0.453 . . . . 1.93 109.778 172.071 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.409 ' HA ' HE21 ' A' ' 85' ' ' GLN . 0.4 OUTLIER -72.18 -30.07 64.61 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.689 -0.687 . . . . 2.91 110.288 -178.074 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.681 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.5 tp10 -55.88 -47.52 77.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.334 -0.848 . . . . 1.66 111.588 175.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.775 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 54.4 mt -49.96 -30.87 11.23 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 114.8 -1.091 . . . . 0.58 113.58 -178.259 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.409 HE21 ' HA ' ' A' ' 82' ' ' GLU . 2.4 mp0 -55.54 -18.06 6.63 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.562 0.578 . . . . 0.92 112.562 -179.253 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -87.08 -8.19 57.31 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.749 0.309 . . . . 1.02 111.228 179.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.488 HD12 ' HB2' ' A' ' 90' ' ' PHE . 0.4 OUTLIER -133.27 175.87 10.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.885 -0.413 . . . . 0.77 109.885 -177.588 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 14.4 p80 -116.28 -13.99 11.07 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.622 -0.431 . . . . 1.85 110.969 173.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.504 ' HB3' ' HB3' ' A' ' 54' ' ' SER . . . -162.15 105.94 1.18 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.919 0.39 . . . . 0.78 111.418 -178.447 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . 0.488 ' HB2' HD12 ' A' ' 87' ' ' ILE . 91.2 t80 -132.17 122.04 24.66 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.919 -0.582 . . . . 0.63 110.046 175.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.4 p -116.54 144.8 43.9 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.712 0.291 . . . . 1.27 110.721 179.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -123.38 145.95 48.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.945 0.402 . . . . 0.64 111.102 -178.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 26.4 mmtp -125.66 120.23 30.17 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.877 -0.786 . . . . 2.23 108.877 177.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.407 ' HA ' HG23 ' A' ' 59' ' ' ILE . 5.9 p -101.25 135.47 42.67 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.487 0.551 . . . . 1.38 112.487 -172.32 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 8.5 m80 -147.74 172.61 13.82 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.536 -0.756 . . . . 1.98 109.473 174.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.413 HG21 ' HB3' ' A' ' 65' ' ' GLU . 0.3 OUTLIER -111.04 158.67 35.19 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-O 121.014 0.435 . . . . 0.76 111.843 -177.925 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.5 ' HG2' ' ND2' ' A' ' 62' ' ' ASN . 26.1 Cg_exo -62.25 -18.36 61.99 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.201 2.601 . . . . 0.72 112.353 -177.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -59.63 -51.23 70.69 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.895 -0.593 . . . . 2.08 109.989 174.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -60.97 -44.81 96.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.109 0.481 . . . . 2.69 110.153 175.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.487 ' HB3' ' HA ' ' A' ' 97' ' ' PRO . 74.1 t80 -57.6 -41.24 80.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.367 -0.833 . . . . 1.46 111.486 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -58.87 -39.47 81.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.421 -0.354 . . . . 1.23 111.646 -178.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.694 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.8 OUTLIER -65.4 -37.68 87.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.817 0.341 . . . . 2.66 110.222 179.363 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.578 ' HA ' ' HA2' ' A' ' 107' ' ' GLY . 69.8 mt -65.24 -49.86 68.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.703 -0.68 . . . . 1.31 111.114 -179.025 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -35.28 78.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.469 -0.332 . . . . 1.84 111.298 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 31.1 t -63.74 -50.54 68.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.691 0.281 . . . . 2.05 110.608 -178.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.13 -43.77 0.1 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.053 0.454 . . . . 4.02 110.676 178.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.578 ' HA2' ' HA ' ' A' ' 103' ' ' LEU . . . 138.92 -35.51 1.98 Allowed Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.639 -0.71 . . . . 3.92 111.575 178.862 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.9 t . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.494 -0.765 . . . . 4.98 110.159 -179.067 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.8 ttp . . . . . 0 N--CA 1.478 0.948 0 CA-C-O 120.866 0.365 . . . . 36.14 110.401 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -171.65 -134.08 1.73 Allowed Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 121.055 -0.593 . . . . 33.7 111.846 178.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.9 m -110.32 153.53 24.76 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.744 0.307 . . . . 32.35 110.211 178.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.8 m -141.06 95.83 2.9 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.882 -0.414 . . . . 30.38 109.882 177.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -75.15 98.3 3.68 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.213 -0.662 . . . . 28.39 109.213 178.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.5 p-80 -78.44 132.0 37.12 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.1 -0.5 . . . . 28.54 111.857 -173.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.7 p-80 -114.32 143.03 45.54 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.577 -0.738 . . . . 26.47 109.304 177.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -170.3 118.33 0.55 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.641 0.258 . . . . 24.34 110.496 175.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 9.9 p-80 -153.17 123.72 7.21 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.125 0.488 . . . . 23.8 110.819 174.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 17.9 t60 -88.01 95.35 10.1 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.487 -0.931 . . . . 20.9 108.487 173.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.5 m -126.28 118.65 25.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.097 -0.501 . . . . 19.89 111.057 -172.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.9 p -120.53 110.76 16.85 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.21 -0.45 . . . . 17.26 110.605 179.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 130.78 74.62 0.13 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.586 -0.816 . . . . 16.67 112.84 178.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.02 -17.93 3.82 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.98 0.419 . . . . 19.13 111.389 177.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -87.49 7.11 30.82 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.529 -0.305 . . . . 14.57 111.451 -175.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -73.93 -12.78 60.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.929 0.395 . . . . 15.4 110.718 -178.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.2 mp -75.88 -14.65 60.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.063 -0.517 . . . . 16.35 110.69 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -100.9 125.4 47.45 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.18 -0.464 . . . . 15.41 110.029 -177.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.9 p90 -98.07 15.78 23.16 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.285 -0.416 . . . . 11.39 111.051 -175.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 65.32 35.72 7.4 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.905 -0.589 . . . . 10.77 110.349 179.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -58.46 -45.36 94.54 Favored Glycine 0 C--N 1.334 0.435 0 CA-C-N 115.631 -0.713 . . . . 6.73 112.432 -179.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -138.34 98.61 3.64 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.48 0.657 . . . . 6.08 110.246 177.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 81.4 mmm -109.69 -45.92 3.59 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.93 -0.577 . . . . 4.41 109.479 178.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 51.8 t -159.86 134.07 7.48 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.388 -0.824 . . . . 1.71 109.512 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.517 HD11 ' HB3' ' A' ' 86' ' ' ASN . 9.6 tp -61.41 -32.88 54.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.832 0.349 . . . . 1.37 110.899 -179.097 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -63.67 -38.9 92.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.266 -0.425 . . . . 1.75 110.186 178.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -67.16 -34.11 76.86 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.981 -0.554 . . . . 2.5 110.694 177.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 71.3 t -59.0 -55.35 24.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.716 0.293 . . . . 1.04 110.619 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.478 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 2.0 mp -63.91 -44.63 98.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.982 -0.554 . . . . 0.79 110.455 178.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.456 ' O ' ' HB2' ' A' ' 34' ' ' SER . 21.0 tt0 -52.4 -51.12 60.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.849 -0.614 . . . . 2.2 110.904 179.332 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -71.81 -38.07 70.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.446 -0.797 . . . . 1.67 111.344 -173.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -60.19 -55.96 27.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.322 -0.399 . . . . 2.03 111.583 -176.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 3.7 pp -74.1 -25.32 59.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.671 -0.241 . . . . 0.57 111.508 -178.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.456 ' HB2' ' O ' ' A' ' 30' ' ' GLU . 8.0 t -68.65 -36.76 79.0 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 121.044 -0.262 . . . . 1.29 110.652 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.1 m -70.43 -27.49 64.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.762 0.315 . . . . 0.78 110.946 178.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.429 ' CB ' HG12 ' A' ' 79' ' ' ILE . . . -85.25 -54.88 4.33 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.067 0.395 . . . . 0.64 112.067 -176.061 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.5 mt -85.09 -34.84 22.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.647 0.26 . . . . 0.94 110.839 -176.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.5 ttmt 58.92 84.78 0.2 Allowed Pre-proline 0 C--O 1.234 0.26 0 CA-C-N 115.391 -0.822 . . . . 3.36 111.727 178.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.755 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 93.8 Cg_endo -93.77 161.27 2.28 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 123.073 2.516 . . . . 0.63 112.72 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 32.7 p -89.4 -21.1 23.22 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.695 0.76 . . . . 0.73 109.177 173.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.625 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 89.9 t80 -141.39 132.07 25.63 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.053 -0.976 . . . . 0.76 109.47 175.079 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.5 tp -140.67 127.69 20.74 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.268 -0.423 . . . . 1.55 110.249 -179.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -139.14 124.11 18.82 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.959 0.409 . . . . 2.23 110.609 177.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.8 mp -95.84 117.27 30.25 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.934 -0.575 . . . . 1.72 109.509 175.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 31.6 t -103.12 130.64 52.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.684 -0.689 . . . . 1.08 110.262 -176.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -79.34 101.42 8.08 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.819 -0.437 . . . . 1.83 109.819 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.412 ' HG3' ' HB2' ' A' ' 56' ' ' ASP . 11.4 mmmm -92.49 59.22 3.33 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.316 0.579 . . . . 2.76 110.354 -175.053 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.621 ' HA ' ' O ' ' A' ' 51' ' ' CYS . 3.0 p -80.65 16.26 1.45 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.516 -0.766 . . . . 3.2 111.914 -177.279 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 53.1 t -59.31 -42.27 91.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.08 -0.509 . . . . 4.74 110.673 177.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -146.09 19.54 1.75 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.626 -0.797 . . . . 3.16 112.187 179.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.621 ' O ' ' HA ' ' A' ' 48' ' ' SER . 75.3 m -148.78 152.79 37.17 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 110.31 -0.256 . . . . 4.36 110.31 -178.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -120.77 152.74 16.78 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.87 -0.681 . . . . 2.26 111.504 176.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.3 p 48.98 43.52 21.99 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.167 0.587 . . . . 3.46 111.658 -179.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.4 m -146.39 136.79 23.87 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.631 -0.713 . . . . 1.71 109.834 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -121.64 161.56 22.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.995 0.426 . . . . 1.15 111.312 -174.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.425 ' HA ' ' O ' ' A' ' 91' ' ' SER . 12.7 t70 -118.15 127.23 53.57 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.252 -1.018 . . . . 1.35 108.252 171.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.91 115.8 30.85 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.138 0.494 . . . . 0.51 111.602 -174.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.3 t -81.76 111.15 17.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.652 -0.704 . . . . 0.55 109.194 174.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.479 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -106.56 114.34 45.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.188 0.518 . . . . 1.18 110.049 -178.494 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.625 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 97.1 t -110.02 103.86 16.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.814 -0.63 . . . . 0.58 109.976 178.054 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.755 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 46.2 t -154.55 149.38 26.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.152 0.501 . . . . 0.84 111.171 -177.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.563 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 40.8 m-80 -67.3 -18.64 65.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.451 -0.795 . . . . 1.67 111.176 176.035 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -47.97 -24.45 1.06 Allowed 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 112.369 0.507 . . . . 1.81 112.369 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.51 ' HD1' ' HB2' ' A' ' 68' ' ' LYS . 76.9 m-85 -118.6 16.05 13.68 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 112.196 0.443 . . . . 3.19 112.196 -178.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.563 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 1.0 OUTLIER -68.82 -15.85 63.62 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 120.795 0.331 . . . . 2.14 111.734 -176.153 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.593 ' HB3' ' HD3' ' A' ' 68' ' ' LYS . 31.0 t70 -84.37 15.6 3.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.252 0.548 . . . . 2.03 110.118 179.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.415 ' NZ ' ' HB2' ' A' ' 67' ' ' LYS . 10.6 mtmp? 57.62 51.02 10.03 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.616 -0.72 . . . . 3.31 109.845 -175.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.914 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 31.2 mmmt -76.91 89.03 3.48 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.871 -0.604 . . . . 1.99 110.436 -176.149 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.7 tt -73.66 -55.01 6.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.294 0.568 . . . . 2.33 109.681 177.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.493 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.5 -31.43 71.56 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.418 -0.81 . . . . 1.09 110.796 -178.341 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.914 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 25.5 t70 -73.68 -35.71 65.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.901 0.382 . . . . 2.08 110.306 -178.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -39.4 93.55 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.317 -0.623 . . . . 2.93 109.317 174.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 39.6 t60 -65.51 -51.35 60.6 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.895 -0.593 . . . . 1.21 110.64 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.544 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 3.8 ptm180 -66.54 -48.19 70.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.311 -0.404 . . . . 1.67 111.81 -176.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -61.39 -45.03 96.06 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.57 0.224 . . . . 1.48 111.446 -177.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.755 HG13 HD22 ' A' ' 80' ' ' LEU . 41.9 t -59.99 -42.57 90.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.427 -0.351 . . . . 0.82 110.732 178.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.62 -43.6 89.06 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.947 -0.301 . . . . 1.14 111.181 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 45.1 m -61.82 -55.92 24.93 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.988 0.366 . . . . 0.69 111.988 -177.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.429 HG12 ' CB ' ' A' ' 36' ' ' ALA . 4.2 mp -78.5 -48.6 22.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 120.819 0.342 . . . . 0.77 111.416 -176.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.774 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.7 mp -73.48 -6.68 47.92 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 116.509 -0.314 . . . . 0.78 111.741 -173.616 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -49.75 -54.59 18.09 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.335 -0.617 . . . . 1.93 109.335 167.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.428 ' O ' ' HG2' ' A' ' 85' ' ' GLN . 36.6 tt0 -75.19 -40.27 59.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.467 -0.788 . . . . 2.91 110.713 178.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.774 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.8 tp10 -53.71 -51.34 63.58 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.456 -0.793 . . . . 1.66 112.025 -177.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.687 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 67.3 mt -50.31 -30.71 12.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.204 -0.907 . . . . 0.58 112.614 -177.089 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.428 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 17.6 mm-40 -52.24 -26.53 12.03 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 111.886 0.328 . . . . 0.92 111.886 -176.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.517 ' HB3' HD11 ' A' ' 25' ' ' ILE . 29.8 m-80 -100.23 1.49 41.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.872 0.367 . . . . 1.02 111.209 -177.231 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.456 HD11 ' HG3' ' A' ' 83' ' ' GLU . 0.5 OUTLIER -130.56 175.9 9.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 110.007 -0.368 . . . . 0.77 110.007 -175.552 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 56.1 m-70 -123.16 -73.85 0.63 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.314 0.578 . . . . 1.85 110.008 176.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -104.91 57.72 0.69 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.406 -0.816 . . . . 0.78 110.505 -175.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -75.19 145.27 42.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.984 -0.553 . . . . 0.63 110.887 -177.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.425 ' O ' ' HA ' ' A' ' 56' ' ' ASP . 40.1 t -140.32 167.62 21.72 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.927 -0.579 . . . . 1.27 109.513 178.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -148.58 149.88 32.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.713 0.292 . . . . 0.64 110.707 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -125.03 109.85 13.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.183 -0.462 . . . . 2.23 110.044 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.423 ' HA ' HG23 ' A' ' 59' ' ' ILE . 4.1 p -83.41 126.91 33.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.23 0.538 . . . . 1.38 111.713 -176.287 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.452 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 45.9 m80 -142.07 162.94 34.22 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.556 -0.747 . . . . 1.98 110.038 178.274 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.5 p -112.56 154.61 44.6 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 116.524 -0.307 . . . . 0.76 110.963 176.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.497 ' HG2' ' ND2' ' A' ' 62' ' ' ASN . 35.8 Cg_exo -59.1 -26.69 82.62 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 123.031 2.487 . . . . 0.72 112.522 -178.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -61.2 -46.43 90.48 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.872 -0.604 . . . . 2.08 110.173 177.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -71.57 -41.07 69.49 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.802 -0.635 . . . . 2.69 110.706 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -56.73 -40.94 76.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.906 -0.588 . . . . 1.46 111.614 -178.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -58.1 -35.89 72.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.85 0.357 . . . . 1.23 111.043 -178.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.692 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -74.18 -32.58 63.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.802 0.334 . . . . 2.66 110.288 179.04 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 85.8 mt -69.05 -52.12 31.89 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.323 -0.399 . . . . 1.31 110.54 179.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -68.32 -14.12 62.76 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.051 -0.522 . . . . 1.84 111.598 -178.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 4.9 t -59.58 -34.06 72.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.064 0.459 . . . . 2.05 109.951 179.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.79 -42.55 3.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.071 -0.513 . . . . 4.02 110.8 175.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 107.51 38.58 2.06 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.969 -0.634 . . . . 3.92 111.631 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 42.2 p . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.859 -0.591 . . . . 4.98 110.092 -178.744 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.6 mtp . . . . . 0 N--CA 1.482 1.161 0 N-CA-C 110.185 -0.302 . . . . 36.14 110.185 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -161.91 148.34 15.61 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.576 -0.821 . . . . 33.7 112.789 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.0 t -131.11 98.93 4.71 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.321 -0.622 . . . . 32.35 109.321 175.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.501 ' O ' ' HD2' ' A' ' 5' ' ' HIS . 41.2 m -67.53 135.81 53.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.011 -0.54 . . . . 30.38 111.79 -174.402 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.501 ' HD2' ' O ' ' A' ' 4' ' ' SER . 0.6 OUTLIER 31.94 45.98 0.05 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.351 1.46 . . . . 28.39 114.233 178.309 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.5 t-80 -95.83 4.93 52.42 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.938 0.399 . . . . 28.54 110.599 -178.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -105.13 22.67 14.93 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.993 0.425 . . . . 26.47 110.574 178.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.7 m170 -117.14 127.48 54.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.308 -0.405 . . . . 24.34 110.683 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 63.6 t-80 -176.16 118.82 0.14 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.851 -0.613 . . . . 23.8 109.481 177.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -156.94 171.77 19.86 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.818 0.342 . . . . 20.9 110.866 177.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.5 m -77.39 159.19 29.65 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.784 -0.644 . . . . 19.89 109.682 175.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.2 m 61.93 95.35 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.215 0.531 . . . . 17.26 111.381 -178.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -131.78 -61.09 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.905 -0.664 . . . . 16.67 112.88 -177.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.689 ' HD3' ' H ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -126.92 -8.92 6.03 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.174 0.512 . . . . 19.13 111.15 -174.847 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.798 ' HG3' ' HA ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -104.58 -16.87 14.9 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.682 -0.69 . . . . 14.57 110.246 -175.887 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.412 ' N ' HD22 ' A' ' 16' ' ' ASN . 0.1 OUTLIER -66.94 5.08 0.71 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.56 -0.746 . . . . 15.4 112.478 -179.067 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.6 mp -68.05 -26.59 65.94 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 109.799 -0.445 . . . . 16.35 109.799 174.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -83.87 89.05 7.14 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.845 -0.798 . . . . 15.41 108.845 174.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.467 ' CE2' ' HA3' ' A' ' 21' ' ' GLY . 21.6 p90 -94.23 19.44 9.38 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.912 -1.04 . . . . 11.39 111.552 -171.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.551 ' HG3' ' OE1' ' A' ' 30' ' ' GLU . 2.6 mp0 70.9 19.0 5.91 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.508 0.505 . . . . 10.77 111.209 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.467 ' HA3' ' CE2' ' A' ' 19' ' ' PHE . . . -90.97 -70.16 1.2 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.43 -0.89 . . . . 6.73 113.244 -177.018 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 28.9 t60 -68.43 133.95 49.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.7 0.286 . . . . 6.08 110.893 -176.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.6 ttt -56.16 122.77 12.47 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.827 -0.624 . . . . 4.41 110.909 177.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.4 t -149.66 160.9 43.13 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.47 -0.567 . . . . 1.71 109.47 -177.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.505 HD11 ' HB3' ' A' ' 86' ' ' ASN . 8.6 tp -56.87 -35.82 47.92 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-O 120.886 0.374 . . . . 1.37 110.291 176.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -58.4 -45.98 87.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.832 -0.622 . . . . 1.75 110.527 176.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.817 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -57.66 -42.85 84.33 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.85 -0.614 . . . . 2.5 110.627 -178.869 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.526 ' O ' ' HG2' ' A' ' 32' ' ' LYS . 60.4 t -58.82 -49.98 81.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-N 116.023 -0.535 . . . . 1.04 110.711 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.551 HD11 ' HB2' ' A' ' 86' ' ' ASN . 1.7 mp -58.8 -46.01 91.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.895 -0.593 . . . . 0.79 110.243 178.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.551 ' OE1' ' HG3' ' A' ' 20' ' ' GLN . 62.2 mt-10 -53.33 -50.42 65.03 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.106 -0.497 . . . . 2.2 111.037 177.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -60.03 -33.88 72.62 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.227 -0.442 . . . . 1.67 111.853 -176.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.526 ' HG2' ' O ' ' A' ' 28' ' ' VAL . 14.8 mmmm -71.27 -55.65 7.63 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.858 -0.337 . . . . 2.03 111.091 -178.105 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.496 HD12 ' N ' ' A' ' 34' ' ' SER . 4.1 pp -69.43 -28.55 66.23 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.9 0.333 . . . . 0.57 111.9 -176.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.496 ' N ' HD12 ' A' ' 33' ' ' LEU . 52.5 p -72.1 -33.29 67.74 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.876 -0.33 . . . . 1.29 110.884 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 52.3 m -68.14 -34.84 77.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.916 0.388 . . . . 0.78 110.755 178.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.28 -54.56 4.24 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.243 0.46 . . . . 0.64 112.243 -175.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.3 mt -81.6 -23.85 36.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.396 -0.365 . . . . 0.94 110.805 -175.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.401 ' HA ' ' O ' ' A' ' 34' ' ' SER . 64.3 mttp 49.28 69.19 2.84 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 115.579 -0.737 . . . . 3.36 112.193 -179.473 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.508 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 71.5 Cg_endo -80.85 134.53 9.62 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.039 1.826 . . . . 0.63 112.034 176.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 20.8 p -67.02 -30.72 70.88 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.091 0.472 . . . . 0.73 110.045 177.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.585 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 81.3 t80 -140.43 139.16 35.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.811 -0.632 . . . . 0.76 109.851 176.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 60.9 tp -135.1 121.69 20.69 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.339 -0.391 . . . . 1.55 110.131 178.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.404 ' HB3' ' HB ' ' A' ' 58' ' ' VAL . 43.3 tt0 -119.49 115.74 24.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.982 0.42 . . . . 2.23 110.517 179.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -91.26 115.64 28.19 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.06 -0.518 . . . . 1.72 109.735 178.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.798 ' HA ' ' HG3' ' A' ' 15' ' ' GLU . 40.4 t -114.41 142.44 27.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.498 0.666 . . . . 1.08 110.676 -178.219 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.56 123.92 23.53 Favored 'General case' 0 N--CA 1.438 -1.041 0 CA-C-N 114.957 -1.019 . . . . 1.83 108.836 178.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.404 ' HD3' ' HB2' ' A' ' 54' ' ' SER . 45.4 tttp -69.1 113.57 6.59 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.929 -0.578 . . . . 2.76 111.335 -169.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.3 m -60.21 114.94 3.15 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.291 -0.868 . . . . 3.2 111.428 -178.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 86.5 m 68.16 23.42 7.94 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.259 -0.882 . . . . 4.74 111.402 177.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -71.72 122.73 9.44 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.473 -0.87 . . . . 3.16 111.423 175.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 62.7 m -73.25 92.82 1.81 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.043 0.449 . . . . 4.36 110.71 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 105.32 177.68 24.21 Favored Glycine 0 N--CA 1.443 -0.868 0 N-CA-C 111.462 -0.655 . . . . 2.26 111.462 -177.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.552 ' O ' ' HB3' ' A' ' 88' ' ' HIS . 28.3 m -64.33 98.02 0.22 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.356 0.598 . . . . 3.46 110.299 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.509 ' HB3' ' HB3' ' A' ' 89' ' ' ALA . 4.2 p -128.14 138.82 52.66 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.64 -0.709 . . . . 1.71 110.571 -176.371 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -113.12 132.53 55.41 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.115 -0.493 . . . . 1.15 110.03 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -114.82 109.5 18.26 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.342 -0.984 . . . . 1.35 108.342 175.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -105.99 120.06 40.79 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.256 0.55 . . . . 0.51 111.832 -170.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.404 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 59.0 t -79.26 114.21 19.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 115.35 -0.841 . . . . 0.55 109.016 173.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.487 ' CG1' ' HA ' ' A' ' 94' ' ' CYS . 1.2 pp -96.73 136.19 28.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.719 -0.475 . . . . 1.18 109.719 -177.498 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.585 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 90.0 t -130.81 97.9 3.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 108.772 -0.825 . . . . 0.58 108.772 176.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.508 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 40.8 t -145.39 150.92 37.43 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.291 0.567 . . . . 0.84 111.977 -173.151 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.691 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 15.7 m120 -67.96 -19.15 64.93 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.354 -0.839 . . . . 1.67 110.178 172.029 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -62.57 -9.07 7.6 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.013 0.435 . . . . 1.81 111.325 -178.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -116.34 -11.83 11.18 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.125 0.417 . . . . 3.19 112.125 -177.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.691 ' HG3' ' O ' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -74.01 -13.73 60.91 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.382 0.512 . . . . 2.14 112.382 -171.473 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.444 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . 7.7 t70 -91.55 10.95 25.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.006 0.431 . . . . 2.03 110.059 178.268 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.49 ' HE3' ' HB2' ' A' ' 67' ' ' LYS . 24.9 ttmt 65.97 39.05 4.66 Favored 'General case' 0 C--N 1.338 0.105 0 CA-C-N 115.627 -0.715 . . . . 3.31 109.392 176.473 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.642 ' HB3' ' HB2' ' A' ' 71' ' ' ASP . 64.4 mmtt -78.93 101.29 7.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.2 -0.909 . . . . 1.99 112.469 -173.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 28.9 tp -73.81 -59.74 2.58 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.026 -0.534 . . . . 2.33 110.146 171.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.431 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.82 -34.12 76.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.756 -0.657 . . . . 1.09 111.821 -170.895 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.642 ' HB2' ' HB3' ' A' ' 68' ' ' LYS . 27.1 m-20 -73.86 -43.55 58.27 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.699 0.259 . . . . 2.08 111.699 -176.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 34.9 ptt180 -64.6 -35.37 80.78 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.079 -0.648 . . . . 2.93 109.586 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -65.13 -52.99 51.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.874 -0.603 . . . . 1.21 110.498 179.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.505 ' CD ' ' HA ' ' A' ' 71' ' ' ASP . 5.8 ptm180 -64.6 -43.46 93.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.254 -0.43 . . . . 1.67 111.296 -175.392 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.421 HD12 ' HG3' ' A' ' 74' ' ' ARG . 8.4 mp -65.56 -48.47 72.3 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.552 0.215 . . . . 1.48 110.961 -178.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.765 HG13 HD22 ' A' ' 80' ' ' LEU . 38.2 t -59.86 -43.88 93.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.554 -0.294 . . . . 0.82 110.866 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -62.76 -46.83 86.22 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.868 -0.333 . . . . 1.14 111.04 -178.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 63.0 m -61.42 -55.94 25.77 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.17 0.433 . . . . 0.69 112.17 -177.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.0 mp -75.29 -50.25 24.94 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 120.968 0.413 . . . . 0.77 111.208 -175.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.972 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.5 mp -71.74 -5.5 34.47 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 116.371 -0.377 . . . . 0.78 111.279 -177.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -49.92 -63.97 0.95 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.065 0.46 . . . . 1.93 109.834 170.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.428 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 5.4 pt-20 -75.39 -31.43 60.45 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.156 -0.474 . . . . 2.91 110.929 177.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.972 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 34.0 tt0 -58.48 -43.96 89.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.543 -0.299 . . . . 1.66 111.127 -177.222 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.76 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 69.3 mt -57.54 -30.6 65.33 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.127 -0.488 . . . . 0.58 111.671 179.435 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.428 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 24.4 mm-40 -59.54 -17.93 36.39 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.848 0.356 . . . . 0.92 111.121 -177.202 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.551 ' HB2' HD11 ' A' ' 29' ' ' ILE . 23.4 m-80 -102.44 3.05 37.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.428 -0.351 . . . . 1.02 110.957 -177.007 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.497 HG21 ' HB2' ' A' ' 90' ' ' PHE . 8.9 mt -124.12 147.67 28.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.645 0.259 . . . . 0.77 110.564 -175.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.552 ' HB3' ' O ' ' A' ' 53' ' ' THR . 59.0 t60 -78.97 -45.18 20.88 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.811 -0.44 . . . . 1.85 109.811 175.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.509 ' HB3' ' HB3' ' A' ' 54' ' ' SER . . . -158.92 106.16 1.81 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 0.78 110.504 178.446 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . 0.497 ' HB2' HG21 ' A' ' 87' ' ' ILE . 76.2 t80 -103.35 138.02 40.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.259 -0.428 . . . . 0.63 110.357 177.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 50.7 m -140.26 145.14 36.94 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.668 -0.493 . . . . 1.27 109.668 175.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -123.35 151.79 42.16 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.168 0.508 . . . . 0.64 111.637 -175.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.0 mmtm -117.38 118.28 31.8 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.437 -0.801 . . . . 2.23 108.957 173.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.487 ' HA ' ' CG1' ' A' ' 59' ' ' ILE . 80.8 m -83.78 117.23 23.13 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.137 0.494 . . . . 1.38 111.605 -171.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 70.2 m80 -140.33 161.22 38.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.958 -0.565 . . . . 1.98 110.332 176.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.653 ' HB ' ' HD2' ' A' ' 97' ' ' PRO . 31.0 p -110.63 168.25 7.88 Favored Pre-proline 0 C--N 1.32 -0.676 0 N-CA-C 109.209 -0.664 . . . . 0.76 109.209 174.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.653 ' HD2' ' HB ' ' A' ' 96' ' ' THR . 12.1 Cg_endo -58.29 -28.53 84.88 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.092 1.861 . . . . 0.72 111.456 174.128 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.404 ' H ' HD22 ' A' ' 98' ' ' LEU . 2.6 mm? -72.92 -51.44 18.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 2.08 109.883 178.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.578 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 1.5 mp0 -58.54 -50.99 71.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.008 -0.542 . . . . 2.69 111.133 179.357 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -65.21 -43.39 91.71 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.742 0.275 . . . . 1.46 111.742 -175.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.484 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 33.3 t70 -62.99 -33.31 75.14 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.988 0.423 . . . . 1.23 110.769 -177.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.606 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.3 OUTLIER -78.41 -15.53 58.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.486 -0.325 . . . . 2.66 111.173 179.024 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 93.6 mt -76.49 -51.69 11.26 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.087 0.47 . . . . 1.31 109.947 175.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.484 ' HG3' ' O ' ' A' ' 101' ' ' ASP . 5.2 ptmt -65.53 -8.62 20.59 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.653 -0.703 . . . . 1.84 111.137 177.22 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.7 t -72.35 -17.39 61.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.039 -0.528 . . . . 2.05 110.555 178.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.38 -147.28 0.28 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.779 -0.452 . . . . 4.02 109.779 174.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -99.36 52.85 1.05 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.995 -0.621 . . . . 3.92 112.338 -175.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 51.1 m . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.212 -0.899 . . . . 4.98 110.208 177.316 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.7 ptp . . . . . 0 N--CA 1.48 1.045 0 CA-C-O 120.879 0.371 . . . . 36.14 110.562 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -101.74 102.81 2.41 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.962 -0.637 . . . . 33.7 111.574 175.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.8 m -85.61 150.9 24.31 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.708 0.29 . . . . 32.35 110.401 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.2 m -81.83 37.63 0.48 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.266 -0.424 . . . . 30.38 111.208 -177.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -57.53 107.55 0.45 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.062 -0.517 . . . . 28.39 110.61 -179.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 74.6 t60 66.38 4.87 3.42 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.547 -0.751 . . . . 28.54 111.583 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -93.05 23.13 4.46 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.659 0.742 . . . . 26.47 109.512 -178.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -148.07 175.0 11.37 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.657 -0.701 . . . . 24.34 109.595 -178.251 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 7.4 t-160 -88.8 136.69 32.87 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.129 -0.323 . . . . 23.8 110.129 -178.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 44.2 t-80 -93.11 146.64 23.5 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.425 -0.352 . . . . 20.9 110.679 -175.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.1 m 76.34 -50.11 0.59 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.679 0.792 . . . . 19.89 112.649 174.027 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.6 m -88.88 17.43 5.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.195 0.521 . . . . 17.26 110.895 -178.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -83.66 43.27 3.14 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.792 -0.64 . . . . 16.67 111.791 -175.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.565 ' HB2' HD23 ' A' ' 44' ' ' LEU . 14.9 ptp180 -118.84 -32.94 4.36 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.287 0.565 . . . . 19.13 109.658 -178.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -100.47 -3.46 30.8 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.488 -0.778 . . . . 14.57 111.505 -174.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.463 HD22 ' C ' ' A' ' 16' ' ' ASN . 0.4 OUTLIER -72.35 -0.55 12.66 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.207 0.447 . . . . 15.4 112.207 -174.163 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.0 mp -82.88 -16.13 48.76 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.132 -0.321 . . . . 16.35 110.132 176.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -127.88 168.43 15.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.407 -0.36 . . . . 15.41 111.072 -175.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 35.7 p90 -94.76 10.82 33.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.111 -0.495 . . . . 11.39 111.784 -177.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 73.47 -53.57 0.69 Allowed 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 113.356 0.873 . . . . 10.77 113.356 173.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -73.34 63.6 1.76 Allowed Glycine 0 CA--C 1.523 0.536 0 N-CA-C 114.664 0.626 . . . . 6.73 114.664 -170.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -171.72 157.58 4.68 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.799 -0.815 . . . . 6.08 108.799 177.066 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 82.8 mtp -73.56 80.41 1.48 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.361 0.601 . . . . 4.41 110.31 177.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.8 m -91.13 124.36 35.29 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.281 -0.872 . . . . 1.71 110.004 -179.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.492 ' O ' HD13 ' A' ' 29' ' ' ILE . 0.0 OUTLIER -57.18 -35.51 48.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.233 -0.439 . . . . 1.37 110.049 179.672 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.86 HE22 ' HG ' ' A' ' 44' ' ' LEU . 53.6 tp60 -57.35 -53.78 54.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.9 -0.591 . . . . 1.75 110.924 177.341 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.9 tptp -63.88 -40.78 97.32 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.894 -0.594 . . . . 2.5 111.04 -173.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 66.6 t -60.55 -46.94 94.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.208 -0.451 . . . . 1.04 111.041 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.538 ' HA ' ' OE2' ' A' ' 83' ' ' GLU . 1.5 mp -58.84 -47.08 90.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.932 -0.576 . . . . 0.79 110.398 179.036 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.526 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 74.8 mt-10 -56.03 -52.0 65.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 2.2 111.003 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -63.34 -36.82 84.96 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.833 0.679 . . . . 1.67 112.833 -172.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -72.57 -47.87 44.58 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.53 -0.468 . . . . 2.03 111.61 -177.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.481 HD12 ' N ' ' A' ' 34' ' ' SER . 4.6 pp -74.26 -31.41 62.55 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 120.581 -0.448 . . . . 0.57 111.722 -179.197 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.481 ' N ' HD12 ' A' ' 33' ' ' LEU . 66.4 m -68.69 -33.58 74.21 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 121.151 -0.22 . . . . 1.29 111.4 -178.195 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.5 m -67.85 -27.33 66.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.95 0.405 . . . . 0.78 110.812 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.95 -52.74 4.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 0.64 111.767 -177.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 73.2 mt -85.0 -33.06 22.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.532 -0.304 . . . . 0.94 111.738 -173.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm 55.48 75.2 0.62 Allowed Pre-proline 0 N--CA 1.466 0.364 0 CA-C-N 116.045 -0.525 . . . . 3.36 112.173 -178.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.526 ' HB3' HG12 ' A' ' 59' ' ' ILE . 72.4 Cg_endo -82.7 133.77 7.13 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.408 2.072 . . . . 0.63 111.989 175.498 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 37.7 p -73.09 -30.53 63.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.578 0.704 . . . . 0.73 109.753 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -141.88 132.55 25.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.111 -0.95 . . . . 0.76 109.328 176.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.43 HD12 ' HG3' ' A' ' 39' ' ' PRO . 1.1 tt -142.24 118.95 11.08 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.196 -0.668 . . . . 1.55 109.196 179.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -116.96 120.51 38.63 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.89 0.376 . . . . 2.23 110.348 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.86 ' HG ' HE22 ' A' ' 26' ' ' GLN . 4.3 mm? -87.86 121.24 30.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.853 -0.612 . . . . 1.72 110.212 178.154 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 40.9 t -109.35 122.11 63.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.215 -0.448 . . . . 1.08 110.339 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -67.92 102.52 1.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.4 -0.593 . . . . 1.83 109.4 176.312 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.519 ' HD2' ' HB2' ' A' ' 56' ' ' ASP . 51.8 tttm -88.42 44.62 1.21 Allowed 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.362 -0.606 . . . . 2.76 109.362 -178.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.6 m 65.56 75.69 0.34 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-N 114.986 -1.007 . . . . 3.2 110.107 -176.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.1 p -53.7 -60.08 3.77 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.423 -0.808 . . . . 4.74 110.769 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 55.59 -131.12 49.09 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 116.091 -0.504 . . . . 3.16 113.085 175.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 34.1 m -85.39 22.34 1.54 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.017 0.437 . . . . 4.36 110.875 -178.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 99.14 63.73 0.84 Allowed Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.92 -0.657 . . . . 2.26 111.695 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.0 m -92.89 -87.65 0.23 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.573 0.225 . . . . 3.46 111.367 -179.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.9 m -154.58 155.81 35.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.834 0.35 . . . . 1.71 110.987 -175.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -125.28 136.17 53.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.945 -0.57 . . . . 1.15 109.6 173.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.519 ' HB2' ' HD2' ' A' ' 47' ' ' LYS . 19.3 t70 -113.24 122.39 47.31 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.89 -0.411 . . . . 1.35 109.89 -177.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -118.77 122.27 42.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.773 0.321 . . . . 0.51 111.606 -175.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 58.3 t -86.86 111.23 21.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 109.552 -0.536 . . . . 0.55 109.552 176.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.526 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -110.01 116.31 51.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.485 0.659 . . . . 1.18 110.627 -176.521 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.653 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 41.8 t -108.09 114.06 45.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.356 -0.838 . . . . 0.58 109.382 176.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 87.5 p -145.66 146.38 31.28 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.245 -0.582 . . . . 0.84 112.256 -177.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -67.22 -22.8 65.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.462 -0.79 . . . . 1.67 110.755 172.251 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -62.59 -32.11 73.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.094 -0.503 . . . . 1.81 112.282 -172.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 31.6 m-85 -98.41 0.51 45.48 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.959 -0.297 . . . . 3.19 111.256 -178.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.08 -18.97 62.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.556 -0.293 . . . . 2.14 111.742 -173.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -84.46 -9.66 58.18 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.918 0.389 . . . . 2.03 110.862 -175.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt 69.12 19.57 7.94 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.884 0.698 . . . . 3.31 112.884 169.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.662 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 29.0 mmmt -75.07 110.76 9.65 Favored 'General case' 0 C--N 1.327 -0.41 0 O-C-N 121.771 -0.581 . . . . 1.99 109.627 178.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.498 ' HA ' ' NE ' ' A' ' 72' ' ' ARG . 3.4 pp -66.53 -48.11 70.76 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.319 0.489 . . . . 2.33 112.319 -167.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.426 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.82 -30.93 70.46 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.877 0.37 . . . . 1.09 110.767 -178.204 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.426 ' N ' HD22 ' A' ' 70' ' ' LEU . 20.4 t70 -73.32 -47.54 41.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.003 -0.544 . . . . 2.08 110.341 -175.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.662 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 10.9 ptt85 -66.68 -33.93 76.75 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.409 -0.36 . . . . 2.93 110.806 177.044 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -66.82 -50.29 63.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.48 -0.327 . . . . 1.21 110.739 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -65.67 -37.33 86.19 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.61 -0.268 . . . . 1.67 110.995 -176.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 66.9 mt -64.13 -57.85 8.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.843 0.354 . . . . 1.48 110.886 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.756 HG13 HD12 ' A' ' 80' ' ' LEU . 64.4 t -57.41 -49.99 78.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.053 -0.521 . . . . 0.82 111.541 -176.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.456 HD22 ' N ' ' A' ' 77' ' ' ASN . 0.9 OUTLIER -65.69 -42.89 90.68 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.959 -0.296 . . . . 1.14 111.57 -174.447 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 85.2 m -63.24 -53.98 44.47 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.852 0.316 . . . . 0.69 111.852 -176.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.4 mp -76.95 -51.1 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.81 0.338 . . . . 0.77 111.196 -177.109 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.871 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 15.4 mt -72.06 -15.16 62.02 Favored 'General case' 0 C--O 1.214 -0.8 0 N-CA-C 113.068 0.766 . . . . 0.78 113.068 -171.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 31.3 tttm -65.82 -56.11 13.61 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 119.163 0.892 . . . . 1.93 109.892 175.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.427 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . 15.0 tm-20 -58.37 -32.58 68.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.323 -0.853 . . . . 2.91 109.499 176.059 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.66 ' HG2' HD23 ' A' ' 80' ' ' LEU . 6.0 tp10 -60.48 -53.74 53.88 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 114.912 -1.04 . . . . 1.66 111.11 176.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.871 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 45.4 mt -50.33 -30.65 12.56 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 114.276 -1.329 . . . . 0.58 112.059 178.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.427 ' HG2' ' HA ' ' A' ' 82' ' ' GLU . 30.7 mm-40 -51.79 -24.83 6.52 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 111.721 0.267 . . . . 0.92 111.721 -177.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.53 ' HB2' HD11 ' A' ' 29' ' ' ILE . 32.5 m-80 -94.07 -6.77 44.36 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.839 0.352 . . . . 1.02 111.417 -178.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 2.7 mt -120.26 151.18 22.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 109.891 -0.411 . . . . 0.77 109.891 -174.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -75.48 -45.81 36.18 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.267 -0.573 . . . . 1.85 109.721 175.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.67 117.26 3.99 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.024 -0.534 . . . . 0.78 110.18 177.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -116.02 122.35 44.95 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.108 -0.496 . . . . 0.63 110.669 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.7 p -115.33 129.5 56.62 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.322 -0.399 . . . . 1.27 110.253 176.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -107.33 139.49 41.72 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.162 0.506 . . . . 0.64 110.591 -178.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -108.14 111.03 22.84 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.088 -0.708 . . . . 2.23 109.088 176.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 45.8 t -83.23 116.14 22.26 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.339 -0.391 . . . . 1.38 110.354 -174.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.653 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 59.2 t60 -130.12 138.98 50.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.478 0.656 . . . . 1.98 110.35 -178.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -98.2 146.36 31.4 Favored Pre-proline 0 C--N 1.318 -0.803 0 CA-C-N 115.561 -0.745 . . . . 0.76 111.383 -179.364 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.459 ' HA ' ' HB3' ' A' ' 100' ' ' TYR . 37.1 Cg_endo -67.14 -21.84 48.05 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.962 2.441 . . . . 0.72 112.808 -178.229 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -64.14 -51.29 64.59 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.045 -0.724 . . . . 2.08 109.045 177.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -70.76 -29.58 65.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.997 -0.547 . . . . 2.69 110.653 178.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.459 ' HB3' ' HA ' ' A' ' 97' ' ' PRO . 85.3 t80 -62.27 -41.05 98.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.197 -0.456 . . . . 1.46 110.662 178.14 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -60.97 -33.66 73.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 1.23 110.943 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.704 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.5 OUTLIER -71.6 -24.95 61.98 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.32 -0.4 . . . . 2.66 110.952 -179.552 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 86.1 mt -75.57 -51.79 12.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.36 -0.382 . . . . 1.31 110.25 178.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.4 -15.69 63.65 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.1 -0.5 . . . . 1.84 111.592 178.336 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 37.0 t -69.95 -47.63 61.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.414 -0.357 . . . . 2.05 110.478 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 42.6 pttt -101.18 -175.76 2.96 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.246 0.546 . . . . 4.02 111.322 -177.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -135.36 29.0 2.96 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 111.223 -0.751 . . . . 3.92 111.223 176.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 26.0 p . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.519 -0.753 . . . . 4.98 109.841 -178.745 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.6 mtp . . . . . 0 N--CA 1.479 1.02 0 N-CA-C 110.113 -0.328 . . . . 36.14 110.113 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -82.21 -67.61 1.49 Allowed Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.727 -0.749 . . . . 33.7 111.573 177.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.1 m -142.65 41.8 1.58 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.084 0.469 . . . . 32.35 110.301 -179.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.1 m -78.98 72.77 5.51 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.911 -0.586 . . . . 30.38 111.591 -176.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 21.2 t-160 -92.52 58.91 3.25 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 107.995 -1.113 . . . . 28.39 107.995 171.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.542 ' HE1' ' HB3' ' A' ' 34' ' ' SER . 78.0 t60 -67.25 -21.87 65.7 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.284 -1.325 . . . . 28.54 111.394 -173.196 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.3 t-160 -80.89 99.51 8.38 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.277 -0.638 . . . . 26.47 109.277 175.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 18.2 m-70 -92.72 -179.78 5.25 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.02 -0.536 . . . . 24.34 110.577 -177.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.17 79.41 1.81 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.897 -0.592 . . . . 23.8 110.203 176.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -81.61 67.25 7.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.539 -0.755 . . . . 20.9 109.03 178.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.5 t -73.25 -21.31 60.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.566 -0.743 . . . . 19.89 110.851 -173.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.2 p -66.56 100.59 0.68 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.916 -0.584 . . . . 17.26 110.521 176.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -91.79 -30.43 10.47 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.839 -0.619 . . . . 16.67 112.561 -176.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.29 -22.75 4.65 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.971 0.415 . . . . 19.13 110.957 -179.364 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -97.76 13.85 28.96 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.233 -0.44 . . . . 14.57 111.459 -176.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -81.65 1.34 34.48 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.906 0.384 . . . . 15.4 110.866 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -94.66 5.83 50.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.992 -0.549 . . . . 16.35 110.299 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -120.38 -175.79 3.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.171 0.51 . . . . 15.41 111.583 -177.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.7 p90 -89.66 18.09 5.83 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.197 -0.91 . . . . 11.39 110.617 -179.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -59.85 100.55 0.09 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.519 -0.764 . . . . 10.77 111.072 178.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.88 89.37 2.1 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.643 -0.789 . . . . 6.73 112.583 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -73.49 112.66 9.77 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.43 -0.582 . . . . 6.08 109.43 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 63.7 mtt -119.05 163.34 17.14 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.818 0.342 . . . . 4.41 111.341 -176.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 43.4 t -70.96 148.35 47.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.587 -0.733 . . . . 1.71 110.725 177.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.4 tp -52.5 -39.45 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 115.669 -0.696 . . . . 1.37 111.75 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -64.83 -39.32 93.38 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.199 0.523 . . . . 1.75 110.914 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.416 ' HB2' ' HE3' ' A' ' 27' ' ' LYS . 39.3 ttmt -70.34 -40.02 74.36 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.513 -0.767 . . . . 2.5 110.658 -177.075 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.3 t -66.21 -46.38 87.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.899 -0.591 . . . . 1.04 111.082 -178.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.58 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.5 mp -59.49 -49.3 84.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.79 111.44 -178.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.418 ' HG3' HD21 ' A' ' 44' ' ' LEU . 1.3 tm-20 -61.17 -39.14 89.01 Favored 'General case' 0 C--O 1.226 -0.177 0 N-CA-C 110.244 -0.28 . . . . 2.2 110.244 -177.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -64.2 -44.24 92.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.528 -0.305 . . . . 1.67 111.079 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -70.53 -55.48 8.79 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 112.343 0.498 . . . . 2.03 112.343 -173.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 3.3 pp -68.69 -29.3 67.72 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.433 -0.507 . . . . 0.57 111.498 -175.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.542 ' HB3' ' HE1' ' A' ' 6' ' ' HIS . 55.0 m -73.4 -35.67 65.91 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.794 -0.362 . . . . 1.29 111.349 177.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.9 m -67.0 -27.46 67.44 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.851 -0.34 . . . . 0.78 111.092 176.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -92.38 -54.9 3.61 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 112.431 0.53 . . . . 0.64 112.431 -176.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.7 mt -79.46 -26.6 41.68 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.832 0.349 . . . . 0.94 110.673 -177.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 65.1 mttm 59.3 72.92 0.74 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.278 -0.874 . . . . 3.36 112.671 176.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.449 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 84.6 Cg_endo -91.29 165.71 3.62 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 122.876 2.384 . . . . 0.63 111.635 172.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 28.6 p -94.22 -32.27 13.75 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.038 0.446 . . . . 0.73 110.258 178.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.708 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 82.8 t80 -133.05 134.37 44.28 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.776 -0.647 . . . . 0.76 109.867 178.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -142.29 113.31 7.53 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.563 -0.532 . . . . 1.55 109.563 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -111.56 134.69 52.96 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.953 -0.388 . . . . 2.23 109.953 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.418 HD21 ' HG3' ' A' ' 30' ' ' GLU . 3.5 mm? -110.92 124.9 53.02 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.782 0.325 . . . . 1.72 110.944 -178.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 48.3 t -127.84 133.9 66.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.056 -0.52 . . . . 1.08 109.692 175.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.408 ' HA ' ' O ' ' A' ' 54' ' ' SER . 5.6 t70 -75.03 134.0 41.51 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 120.91 0.386 . . . . 1.83 110.164 175.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -93.36 -10.46 35.23 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.084 -0.507 . . . . 2.76 110.323 -178.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.554 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 20.1 m 62.24 28.72 17.16 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.748 -0.66 . . . . 3.2 111.516 178.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 47.4 t -78.55 105.23 9.68 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.714 -0.476 . . . . 4.74 109.714 178.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.32 -115.25 5.24 Favored Glycine 0 N--CA 1.445 -0.72 0 N-CA-C 111.422 -0.671 . . . . 3.16 111.422 -177.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 72.0 m -103.62 16.92 25.26 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.137 0.494 . . . . 4.36 110.697 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.554 ' HA2' ' HA ' ' A' ' 48' ' ' SER . . . 85.35 38.21 9.2 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.657 -0.783 . . . . 2.26 112.697 177.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.9 p -119.59 52.87 1.07 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.674 0.75 . . . . 3.46 109.841 175.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.408 ' O ' ' HA ' ' A' ' 46' ' ' ASP . 21.7 p -135.55 132.18 36.89 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.041 -0.982 . . . . 1.71 110.471 -175.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -118.8 132.43 56.13 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 121.014 -0.274 . . . . 1.15 110.86 -178.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -113.0 113.02 24.89 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 107.754 -1.202 . . . . 1.35 107.754 171.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.0 117.88 35.17 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.172 0.511 . . . . 0.51 112.251 -169.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 61.1 t -83.64 112.28 20.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.675 -0.693 . . . . 0.55 109.641 175.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.673 HG13 ' HA ' ' A' ' 94' ' ' CYS . 1.0 OUTLIER -100.53 140.02 20.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.254 -0.43 . . . . 1.18 110.502 -176.051 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.708 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 95.1 t -127.98 107.44 16.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 108.864 -0.791 . . . . 0.58 108.864 171.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.449 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 43.5 t -155.78 154.87 32.07 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.073 0.463 . . . . 0.84 112.028 -174.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.49 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 0.8 OUTLIER -67.07 -19.47 65.67 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 115.558 -0.747 . . . . 1.67 110.333 173.98 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -58.02 -30.47 66.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.608 -0.724 . . . . 1.81 111.031 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -94.73 -11.1 29.73 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.185 0.517 . . . . 3.19 110.665 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.49 ' HB3' ' HA ' ' A' ' 62' ' ' ASN . 0.6 OUTLIER -91.42 -16.13 27.83 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 108.643 -0.873 . . . . 2.14 108.643 -176.962 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -74.22 0.64 13.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.374 -0.83 . . . . 2.03 109.843 175.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 53.3 mmtt 64.98 37.81 6.67 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 114.837 -1.074 . . . . 3.31 110.864 175.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.89 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 42.3 mmtm -96.1 92.07 6.25 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.063 -0.517 . . . . 1.99 111.148 177.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.411 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 5.8 tt -73.64 -57.29 4.09 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.436 -0.579 . . . . 2.33 109.436 177.438 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.433 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -68.18 -32.26 72.37 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.043 -0.526 . . . . 1.09 111.448 -177.388 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.89 ' HB3' ' HB3' ' A' ' 68' ' ' LYS . 24.3 t70 -74.09 -38.65 63.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.363 -0.38 . . . . 2.08 111.431 -173.164 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.411 ' HG2' ' O ' ' A' ' 69' ' ' LEU . 50.9 ptt85 -62.63 -34.54 77.26 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.422 -0.511 . . . . 2.93 109.851 177.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 73.4 t60 -69.05 -46.6 67.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.271 -0.422 . . . . 1.21 110.53 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.527 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 3.7 ptm180 -68.17 -38.77 82.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.659 -0.246 . . . . 1.67 110.884 -178.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -65.67 -47.58 75.03 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.833 -0.167 . . . . 1.48 111.028 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.519 HG13 HD22 ' A' ' 80' ' ' LEU . 37.2 t -57.51 -45.4 85.94 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 CA-C-N 116.567 -0.288 . . . . 0.82 110.665 177.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.543 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -67.35 -29.5 69.07 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.93 -0.308 . . . . 1.14 111.622 -179.031 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 91.5 m -66.25 -48.3 70.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.794 0.33 . . . . 0.69 111.019 -178.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 21.0 mt -81.8 -51.14 15.54 Favored 'Isoleucine or valine' 0 C--O 1.242 0.671 0 CA-C-O 121.952 0.882 . . . . 0.77 110.62 -177.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.954 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.3 mp -74.67 -0.13 16.97 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.195 -0.912 . . . . 0.78 111.27 -176.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.543 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 56.0 tptt -50.86 -63.71 1.04 Allowed 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 108.949 -0.76 . . . . 1.93 108.949 169.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -75.49 -35.68 60.76 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.906 -0.588 . . . . 2.91 110.968 176.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.954 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 30.7 tt0 -59.5 -41.18 89.29 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 111.868 0.321 . . . . 1.66 111.868 -175.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 41.0 mt -56.46 -30.68 63.2 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.185 0.439 . . . . 0.58 112.185 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -57.83 -18.23 20.97 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.72 0.295 . . . . 0.92 111.566 -174.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -100.27 -4.34 29.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.717 -0.22 . . . . 1.02 111.515 -177.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 6.1 mt -115.38 152.12 17.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 109.923 -0.399 . . . . 0.77 109.923 -177.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -84.43 -38.24 20.44 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.825 -0.435 . . . . 1.85 109.825 176.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -161.08 108.41 1.49 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.213 -0.449 . . . . 0.78 111.029 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -105.64 138.29 42.08 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.012 0.434 . . . . 0.63 110.869 176.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 44.5 m -134.61 158.84 43.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.872 -0.604 . . . . 1.27 109.485 175.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -137.0 147.56 46.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.22 0.533 . . . . 0.64 111.755 -176.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 48.7 mmtm -119.3 109.33 15.68 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.44 -0.8 . . . . 2.23 108.978 173.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.673 ' HA ' HG13 ' A' ' 59' ' ' ILE . 4.5 p -84.01 121.29 27.2 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.059 0.457 . . . . 1.38 111.315 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -131.79 153.88 49.67 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.333 0.587 . . . . 1.98 111.224 176.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 17.8 p -97.37 148.55 34.58 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.572 -0.74 . . . . 0.76 110.55 177.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -62.16 -30.25 81.86 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.621 2.214 . . . . 0.72 111.979 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.52 -51.34 60.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.667 -0.697 . . . . 2.08 109.965 -179.138 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.446 ' HA ' ' HE3' ' A' ' 102' ' ' LYS . 12.6 tp10 -72.57 -30.98 64.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.856 0.36 . . . . 2.69 110.489 -178.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -56.09 -35.21 66.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.864 -0.607 . . . . 1.46 111.595 -179.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.456 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 23.8 t70 -62.7 -36.57 83.37 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 121.094 -0.242 . . . . 1.23 111.031 -176.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.446 ' HE3' ' HA ' ' A' ' 99' ' ' GLU . 0.0 OUTLIER -66.62 -33.14 74.99 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.117 0.484 . . . . 2.66 110.495 178.16 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 69.1 mt -67.97 -46.59 70.94 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.903 -0.589 . . . . 1.31 110.251 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 101' ' ' ASP . 0.0 OUTLIER -75.02 -8.25 55.98 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.109 -0.496 . . . . 1.84 111.977 -179.45 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 50.2 m -59.97 -42.68 94.67 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.947 0.404 . . . . 2.05 109.986 174.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.425 ' HE3' ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -100.44 -41.18 7.11 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.123 -0.49 . . . . 4.02 110.26 175.191 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.85 44.57 7.66 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 121.017 -0.611 . . . . 3.92 112.661 176.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.0 p . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.943 -0.551 . . . . 4.98 110.877 179.271 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.6 tpt . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 120.862 0.363 . . . . 36.14 110.391 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 91.66 -138.01 14.06 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.386 -0.911 . . . . 33.7 112.368 177.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.505 ' HA ' ' OD2' ' A' ' 46' ' ' ASP . 74.9 m -60.3 118.2 6.13 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.699 0.761 . . . . 32.35 112.797 -174.012 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.5 m -125.39 -21.12 4.62 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.502 -1.226 . . . . 30.38 109.563 176.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -100.75 112.17 24.53 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.052 -0.522 . . . . 28.39 109.949 178.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -105.94 118.32 36.3 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.43 -0.35 . . . . 28.54 110.135 178.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 49.3 t60 -70.79 129.55 39.39 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.864 -0.421 . . . . 26.47 109.864 177.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 11.8 t-80 -67.93 114.96 6.92 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.507 -0.553 . . . . 24.34 109.507 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.0 t-80 -78.69 53.23 1.31 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.506 0.67 . . . . 23.8 111.296 -174.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -170.48 133.42 1.04 Allowed 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.636 -0.875 . . . . 20.9 108.636 176.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 63.0 m -56.55 109.85 0.69 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.172 0.51 . . . . 19.89 111.2 -179.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.2 p -134.15 48.73 2.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.514 -0.766 . . . . 17.26 110.013 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.465 ' HA2' ' ND2' ' A' ' 16' ' ' ASN . . . -84.8 23.78 7.34 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.508 -0.769 . . . . 16.67 112.478 -176.183 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 46.2 mtm180 -102.43 -50.69 3.53 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.738 0.78 . . . . 19.13 109.635 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -97.82 -16.56 19.77 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.762 -1.108 . . . . 14.57 112.01 -174.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.465 ' ND2' ' HA2' ' A' ' 13' ' ' GLY . 0.1 OUTLIER -74.0 8.74 1.87 Allowed 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.129 0.418 . . . . 15.4 112.129 -175.356 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.429 HD12 ' ND2' ' A' ' 16' ' ' ASN . 8.6 mp -82.04 -10.98 59.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.15 0.5 . . . . 16.35 110.131 176.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.445 ' HB3' ' HG2' ' A' ' 20' ' ' GLN . 97.5 m-85 -107.18 127.83 53.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.933 -0.576 . . . . 15.41 110.214 -179.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -77.14 33.19 0.15 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.029 -0.532 . . . . 11.39 111.825 -179.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.445 ' HG2' ' HB3' ' A' ' 18' ' ' TYR . 30.6 mm-40 -67.94 109.09 3.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.323 -0.399 . . . . 10.77 110.691 179.588 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -142.88 -159.72 8.06 Favored Glycine 0 N--CA 1.445 -0.722 0 C-N-CA 120.735 -0.745 . . . . 6.73 111.817 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 50.0 t60 -106.51 155.48 19.55 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.826 -0.435 . . . . 6.08 109.826 -178.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.6 mmt -58.02 100.52 0.06 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.121 0.486 . . . . 4.41 110.857 175.076 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 79.5 m -146.5 160.1 42.55 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.626 -0.715 . . . . 1.71 109.606 179.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.8 tp -54.8 -31.93 25.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 O-C-N 123.386 0.429 . . . . 1.37 111.414 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -58.6 -49.15 78.52 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.586 -0.279 . . . . 1.75 110.98 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.596 ' HE3' ' OE2' ' A' ' 30' ' ' GLU . 10.2 mmmm -70.91 -27.35 63.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.475 -0.33 . . . . 2.5 111.372 -177.025 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 81.8 t -58.82 -54.12 38.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.902 0.382 . . . . 1.04 110.067 176.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.509 HG12 HD11 ' A' ' 87' ' ' ILE . 1.8 mp -64.95 -48.78 82.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.615 -0.721 . . . . 0.79 110.509 178.336 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.596 ' OE2' ' HE3' ' A' ' 27' ' ' LYS . 27.1 tt0 -58.16 -52.21 66.5 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.966 -0.561 . . . . 2.2 111.461 -175.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -68.13 -31.98 71.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.542 -0.299 . . . . 1.67 111.299 -176.059 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -66.19 -55.66 15.18 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 120.588 0.233 . . . . 2.03 110.995 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 4.0 pp -72.8 -23.84 60.84 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.793 -0.363 . . . . 0.57 111.467 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.558 ' O ' ' HA ' ' A' ' 38' ' ' LYS . 22.7 t -69.08 -36.35 77.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.1 0.476 . . . . 1.29 110.131 176.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.3 m -71.68 -48.92 44.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.221 -0.445 . . . . 0.78 110.812 177.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.61 -54.76 6.84 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.614 0.598 . . . . 0.64 112.614 -173.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.8 mt -80.69 -33.41 35.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.937 0.398 . . . . 0.94 110.272 -177.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.558 ' HA ' ' O ' ' A' ' 34' ' ' SER . 18.7 ttmm 58.01 81.22 0.26 Allowed Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.045 -0.98 . . . . 3.36 112.154 174.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.697 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 5.4 Cg_endo -87.08 147.85 7.94 Favored 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 123.165 2.577 . . . . 0.63 112.197 178.321 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.22 -22.58 33.09 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.456 0.646 . . . . 0.73 109.794 176.122 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.679 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 64.4 t80 -141.63 127.6 19.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.235 -0.893 . . . . 0.76 109.156 171.164 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 48.6 tp -142.32 133.8 26.56 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.396 -0.366 . . . . 1.55 110.273 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -149.6 139.8 22.19 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.858 0.361 . . . . 2.23 110.536 174.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.416 HD22 ' N ' ' A' ' 44' ' ' LEU . 3.1 mm? -88.61 124.68 34.29 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.499 -0.556 . . . . 1.72 109.499 176.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 59.1 t -103.17 135.35 41.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.703 -0.48 . . . . 1.08 109.703 -178.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.505 ' OD2' ' HA ' ' A' ' 3' ' ' SER . 10.3 t70 -69.41 105.01 2.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.905 -1.043 . . . . 1.83 111.082 -172.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.631 ' HE2' ' HB2' ' A' ' 56' ' ' ASP . 16.0 tppt? -95.28 70.75 3.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.402 0.62 . . . . 2.76 109.705 179.344 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 29.8 t -69.64 -16.46 63.37 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.544 -0.753 . . . . 3.2 110.248 178.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 50.3 t -103.44 92.94 4.69 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.068 -0.514 . . . . 4.74 109.63 175.102 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -169.1 -141.59 3.26 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.746 -0.74 . . . . 3.16 111.852 -178.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 56.6 m -109.59 81.11 1.39 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.733 0.302 . . . . 4.36 110.451 -179.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.5 -88.12 0.52 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.176 -0.535 . . . . 2.26 112.289 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.5 m -115.65 101.79 9.16 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.256 0.551 . . . . 3.46 109.749 177.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.5 m -128.66 149.35 50.7 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.613 -0.721 . . . . 1.71 109.968 -177.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -136.39 143.36 43.95 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.592 -0.276 . . . . 1.15 110.481 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.631 ' HB2' ' HE2' ' A' ' 47' ' ' LYS . 38.7 t70 -122.0 115.27 22.22 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.016 -0.735 . . . . 1.35 109.016 175.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.03 119.42 39.14 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.026 0.441 . . . . 0.51 111.648 -171.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.514 ' HA ' ' HB2' ' A' ' 93' ' ' LYS . 62.2 t -75.71 111.25 11.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.229 -0.656 . . . . 0.55 109.229 175.223 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.521 HD11 ' HB3' ' A' ' 61' ' ' SER . 0.0 OUTLIER -113.67 110.53 32.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.911 0.862 . . . . 1.18 110.487 -176.782 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.679 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 98.2 t -107.81 106.44 20.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 114.747 -1.115 . . . . 0.58 108.945 175.596 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.697 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 40.4 t -151.55 155.13 37.84 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.344 0.592 . . . . 0.84 111.792 -173.118 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.526 ' HA ' ' HB3' ' A' ' 65' ' ' GLU . 0.8 OUTLIER -62.02 -19.23 62.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.971 -1.013 . . . . 1.67 111.66 176.269 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.439 ' OD1' ' HB3' ' A' ' 61' ' ' SER . 28.4 p-10 -63.78 -26.18 68.52 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.705 0.288 . . . . 1.81 111.285 -179.182 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.553 ' HD2' HG23 ' A' ' 96' ' ' THR . 59.6 t80 -90.63 -13.2 34.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.439 0.638 . . . . 3.19 109.674 176.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.526 ' HB3' ' HA ' ' A' ' 62' ' ' ASN . 0.9 OUTLIER -87.36 -11.03 50.54 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 108.878 -0.786 . . . . 2.14 108.878 -179.668 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -63.31 -19.46 64.62 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.029 -0.987 . . . . 2.03 110.451 178.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm 78.61 -28.28 0.16 Allowed 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.07 0.948 . . . . 3.31 111.883 176.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -71.24 100.03 2.02 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.929 0.395 . . . . 1.99 110.377 178.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.512 HD12 ' N ' ' A' ' 70' ' ' LEU . 4.0 pp -70.04 -36.31 74.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.277 -0.42 . . . . 2.33 111.432 -175.312 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.512 ' N ' HD12 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -67.79 -32.96 73.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.801 0.334 . . . . 1.09 110.942 178.951 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.522 ' HA ' ' HG2' ' A' ' 74' ' ' ARG . 7.2 m-20 -74.08 -37.73 64.13 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 120.888 0.375 . . . . 2.08 110.126 177.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -57.64 -43.3 84.77 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.377 -0.601 . . . . 2.93 109.377 172.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 30.7 t60 -63.42 -53.31 54.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.558 -0.746 . . . . 1.21 111.143 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.522 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 9.9 ptm180 -63.69 -36.6 84.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.3 -0.409 . . . . 1.67 111.6 -175.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -63.96 -49.48 72.34 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.77 0.319 . . . . 1.48 110.773 178.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 74.6 t -58.57 -42.82 85.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.069 -0.514 . . . . 0.82 110.297 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.536 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -64.3 -35.41 80.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.297 -0.41 . . . . 1.14 111.45 179.372 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 86.8 m -62.2 -51.33 68.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.838 0.351 . . . . 0.69 111.446 -178.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.4 HD12 ' N ' ' A' ' 79' ' ' ILE . 2.9 mp -80.03 -48.88 19.87 Favored 'Isoleucine or valine' 0 C--O 1.241 0.617 0 CA-C-O 121.44 0.638 . . . . 0.77 110.927 -177.295 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.893 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.5 mp -74.94 -2.27 26.28 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.933 -0.576 . . . . 0.78 111.441 -175.206 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.536 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 56.9 tptt -51.6 -64.1 0.92 Allowed 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 109.497 -0.557 . . . . 1.93 109.497 171.208 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.423 ' HG3' ' N ' ' A' ' 83' ' ' GLU . 2.4 pt-20 -75.07 -33.68 61.71 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.001 -0.545 . . . . 2.91 110.867 176.319 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.893 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 5.2 tp10 -55.18 -53.6 53.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.193 0.521 . . . . 1.66 112.049 -175.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 70.3 mt -50.39 -30.67 12.91 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.269 -0.878 . . . . 0.58 112.472 178.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -57.21 -24.34 53.9 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.023 0.44 . . . . 0.92 110.733 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -91.67 -10.82 38.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.064 -0.517 . . . . 1.02 111.47 -175.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.509 HD11 HG12 ' A' ' 29' ' ' ILE . 3.1 mt -120.46 164.13 17.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.746 -0.464 . . . . 0.77 109.746 -176.667 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -92.24 -46.36 7.76 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.505 -0.554 . . . . 1.85 109.505 175.163 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -148.3 109.6 4.36 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.032 -0.531 . . . . 0.78 110.514 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -116.77 127.41 54.32 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.295 -0.412 . . . . 0.63 110.547 177.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 37.0 p -124.44 167.07 14.92 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.412 -0.588 . . . . 1.27 109.412 175.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -143.51 146.01 33.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.919 0.39 . . . . 0.64 111.132 -178.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.514 ' HB2' ' HA ' ' A' ' 58' ' ' VAL . 44.5 mmtm -97.42 109.35 22.12 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.003 -0.74 . . . . 2.23 109.003 174.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 3.9 p -89.9 111.56 22.65 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.062 -0.517 . . . . 1.38 111.018 -174.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.464 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 1.7 m80 -138.3 156.82 47.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.985 -0.552 . . . . 1.98 110.671 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.553 HG23 ' HD2' ' A' ' 64' ' ' PHE . 47.5 p -98.16 153.47 38.09 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.225 -0.443 . . . . 0.76 110.272 177.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -64.39 -22.21 66.09 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.35 2.033 . . . . 0.72 111.191 175.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.402 HD22 ' HA ' ' A' ' 98' ' ' LEU . 1.4 tm? -68.56 -44.0 75.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.262 -0.881 . . . . 2.08 109.411 177.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 57.0 tt0 -75.9 -35.63 59.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.473 -0.785 . . . . 2.69 110.132 178.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -58.43 -32.49 68.74 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.931 -0.577 . . . . 1.46 110.957 178.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -52.03 -36.28 49.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.11 -0.495 . . . . 1.23 111.589 177.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -77.57 -35.43 53.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.101 0.477 . . . . 2.66 110.167 178.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 66.3 mt -77.3 -24.27 50.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.748 -0.66 . . . . 1.31 111.709 -173.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.425 ' HG3' ' N ' ' A' ' 105' ' ' SER . 41.8 pttt -81.58 -32.68 32.0 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.862 -0.335 . . . . 1.84 110.485 177.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.425 ' N ' ' HG3' ' A' ' 104' ' ' LYS . 36.6 m -64.31 -41.97 96.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.996 -0.547 . . . . 2.05 110.009 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.474 ' C ' ' HD2' ' A' ' 106' ' ' LYS . 0.1 OUTLIER -159.43 174.16 15.12 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.698 -0.683 . . . . 4.02 110.34 174.912 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -113.8 -19.85 6.32 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.756 -0.735 . . . . 3.92 112.702 -173.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 56.4 m . . . . . 0 C--O 1.245 0.854 0 CA-C-O 118.343 -0.837 . . . . 4.98 110.236 -177.078 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 46.1 tpp . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 110.124 -0.324 . . . . 36.14 110.124 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.484 ' HA3' ' HG2' ' A' ' 27' ' ' LYS . . . 179.54 -32.01 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.422 -0.894 . . . . 33.7 113.047 179.268 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.611 ' HB2' ' HB3' ' A' ' 30' ' ' GLU . 32.5 t -74.38 130.15 39.12 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.993 0.425 . . . . 32.35 111.06 -179.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.0 t -73.53 128.9 36.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.134 -0.484 . . . . 30.38 109.726 177.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -94.79 21.84 7.05 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.114 -0.493 . . . . 28.39 111.325 -173.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 72.1 m80 -81.88 112.73 19.27 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.973 -0.558 . . . . 28.54 109.55 174.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.408 ' HD2' ' HB2' ' A' ' 38' ' ' LYS . 39.3 t-80 -74.02 82.72 1.74 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.846 -0.615 . . . . 26.47 110.986 -175.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.519 ' HB3' ' HB2' ' A' ' 11' ' ' SER . 91.4 m-70 -97.39 114.65 26.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.974 -0.557 . . . . 24.34 110.117 177.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -82.53 85.42 6.96 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.693 0.283 . . . . 23.8 110.254 178.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 70.0 t60 69.63 6.96 5.98 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.685 -0.688 . . . . 20.9 111.278 176.281 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.519 ' HB2' ' HB3' ' A' ' 8' ' ' HIS . 13.2 m -69.09 -38.45 78.98 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.035 0.445 . . . . 19.89 110.293 177.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 29.6 m -78.58 94.41 5.0 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.909 -0.587 . . . . 17.26 110.548 -179.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -168.89 40.55 0.22 Allowed Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.754 -0.736 . . . . 16.67 112.283 178.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.3 ptp180 -143.06 -34.35 0.43 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.759 0.314 . . . . 19.13 111.495 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.407 ' H ' ' HG2' ' A' ' 15' ' ' GLU . 10.8 pt-20 -85.2 10.74 11.49 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.071 0.463 . . . . 14.57 111.536 -175.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -68.16 -9.3 45.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.624 -0.717 . . . . 15.4 111.054 176.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.432 HD13 ' HA ' ' A' ' 17' ' ' LEU . 4.4 mm? -62.96 -28.54 70.15 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.117 0.484 . . . . 16.35 110.045 173.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -98.49 86.66 3.65 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.502 0.668 . . . . 15.41 109.484 174.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.8 p90 -96.54 11.43 35.16 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.975 -1.012 . . . . 11.39 111.16 -174.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -78.03 64.95 3.33 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.06 0.457 . . . . 10.77 110.489 177.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -140.19 68.54 0.48 Allowed Glycine 0 N--CA 1.446 -0.634 0 CA-C-N 115.578 -0.737 . . . . 6.73 111.521 178.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -53.23 135.67 37.84 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.88 0.371 . . . . 6.08 111.064 179.647 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.549 ' SD ' ' HD2' ' A' ' 27' ' ' LYS . 24.7 ptt? -143.46 140.57 30.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.313 -0.403 . . . . 4.41 111.112 -176.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.444 ' O ' HG23 ' A' ' 28' ' ' VAL . 62.3 m -69.0 167.97 14.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.727 -0.67 . . . . 1.71 111.391 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.1 tp -61.64 -38.39 80.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 116.165 -0.47 . . . . 1.37 111.757 -176.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.2 tt0 -59.3 -43.11 92.65 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.086 0.469 . . . . 1.75 110.504 177.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.549 ' HD2' ' SD ' ' A' ' 23' ' ' MET . 11.7 tmtt? -64.75 -34.55 78.6 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.532 -0.758 . . . . 2.5 109.808 -179.176 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 24' ' ' CYS . 93.6 t -61.71 -43.95 97.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.993 -0.549 . . . . 1.04 110.49 176.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.508 HG13 ' HG3' ' A' ' 83' ' ' GLU . 1.7 mp -67.22 -42.93 88.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.17 -0.468 . . . . 0.79 110.535 178.213 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.611 ' HB3' ' HB2' ' A' ' 3' ' ' SER . 45.1 mt-10 -52.21 -50.38 62.05 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.44 -0.345 . . . . 2.2 111.036 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.465 ' HA ' ' HB3' ' A' ' 34' ' ' SER . 4.6 m-20 -78.79 -18.98 53.24 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.249 0.463 . . . . 1.67 112.249 -178.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.458 ' HE3' HG23 ' A' ' 79' ' ' ILE . 51.5 tptt -61.46 -55.74 27.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.804 0.335 . . . . 2.03 110.21 178.443 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.517 HD11 ' HG ' ' A' ' 42' ' ' LEU . 4.4 pp -73.68 -26.38 60.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.229 -0.442 . . . . 0.57 110.429 176.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.604 ' O ' ' HD2' ' A' ' 38' ' ' LYS . 4.7 t -63.7 -45.96 87.63 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 116.169 -0.468 . . . . 1.29 109.907 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.8 m -53.27 -27.89 24.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.955 0.407 . . . . 0.78 111.231 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.615 ' HB2' HG12 ' A' ' 79' ' ' ILE . . . -89.22 -43.35 11.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.937 -0.574 . . . . 0.64 112.316 -177.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.0 mp -107.06 -36.13 6.68 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.461 0.541 . . . . 0.94 112.461 -173.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.604 ' HD2' ' O ' ' A' ' 34' ' ' SER . 27.9 mmmt 51.01 75.3 0.67 Allowed Pre-proline 0 N--CA 1.468 0.443 0 C-N-CA 123.3 0.64 . . . . 3.36 110.845 -168.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -81.97 141.66 12.01 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.716 2.277 . . . . 0.63 112.391 -178.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.4 p -60.95 -35.05 75.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.594 -0.73 . . . . 0.73 111.182 179.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.687 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 72.4 t80 -138.36 124.09 19.82 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.477 -0.564 . . . . 0.76 109.477 175.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.517 ' HG ' HD11 ' A' ' 33' ' ' LEU . 3.3 tm? -142.54 122.62 13.71 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.748 -0.834 . . . . 1.55 108.748 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.527 ' O ' ' HA ' ' A' ' 57' ' ' ALA . 10.7 tp10 -143.24 140.48 30.7 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.673 -0.411 . . . . 2.23 111.039 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.481 HD13 ' HG2' ' A' ' 30' ' ' GLU . 10.6 mp -106.74 117.41 33.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.086 0.47 . . . . 1.72 110.771 178.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 52.9 t -106.22 119.26 55.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.73 -0.668 . . . . 1.08 109.956 176.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -73.52 122.84 22.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.998 -0.546 . . . . 1.83 110.101 177.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.7 mtmm -110.94 142.36 43.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.283 -0.417 . . . . 2.76 110.719 -177.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.6 p -80.2 90.42 5.5 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.417 -0.586 . . . . 3.2 109.417 171.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 30.1 t -107.32 13.1 27.44 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.033 -0.531 . . . . 4.74 110.81 -174.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 84.38 -40.02 2.93 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.889 -0.672 . . . . 3.16 112.76 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 56.0 m -78.46 38.85 0.32 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.797 0.332 . . . . 4.36 111.136 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.1 -140.08 29.29 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 121.13 -0.557 . . . . 2.26 111.878 -177.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 5.2 t -77.87 127.35 32.25 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.539 0.685 . . . . 3.46 110.732 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.7 p -138.03 135.53 36.0 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.712 -0.676 . . . . 1.71 109.29 177.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -111.33 132.7 54.2 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.184 0.516 . . . . 1.15 110.747 -175.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -112.59 118.55 35.4 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.191 -0.913 . . . . 1.35 108.589 176.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.527 ' HA ' ' O ' ' A' ' 43' ' ' GLU . . . -105.68 115.6 30.52 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.999 0.428 . . . . 0.51 111.68 -173.404 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.413 ' O ' ' HA ' ' A' ' 42' ' ' LEU . 47.3 t -74.43 110.93 9.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 108.589 -0.893 . . . . 0.55 108.589 172.389 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -107.65 109.68 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 CA-C-O 121.862 0.839 . . . . 1.18 109.963 -177.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.687 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 60.2 t -111.26 105.21 18.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 115.026 -0.988 . . . . 0.58 110.088 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 88.2 p -156.75 142.18 17.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.231 0.539 . . . . 0.84 111.238 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.644 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 61.4 m-20 -67.69 -18.49 64.94 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.372 -0.831 . . . . 1.67 112.07 177.529 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -48.99 -36.83 18.53 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.878 0.371 . . . . 1.81 111.029 177.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.603 ' CE1' ' HA ' ' A' ' 72' ' ' ARG . 21.3 m-30 -101.59 21.4 14.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.955 0.407 . . . . 3.19 111.286 -178.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.644 ' HB3' ' O ' ' A' ' 62' ' ' ASN . 0.7 OUTLIER -92.95 -14.57 27.34 Favored 'General case' 0 N--CA 1.426 -1.658 0 N-CA-C 108.407 -0.96 . . . . 2.14 108.407 178.847 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -73.21 -4.02 30.39 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.365 -0.834 . . . . 2.03 109.916 178.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 99.2 mttt 67.45 25.32 8.57 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.359 -0.837 . . . . 3.31 111.888 172.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.524 ' HE2' HD11 ' A' ' 70' ' ' LEU . 13.5 mmmm -93.08 96.53 10.11 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.852 -0.613 . . . . 1.99 109.896 178.172 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.471 HD12 ' N ' ' A' ' 70' ' ' LEU . 4.3 pp -72.35 -33.16 67.08 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.968 -0.293 . . . . 2.33 110.977 -175.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.524 HD11 ' HE2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -67.88 -35.16 78.02 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 120.957 -0.297 . . . . 1.09 110.682 177.662 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.521 ' N ' HD22 ' A' ' 70' ' ' LEU . 23.0 m-20 -71.66 -45.32 62.32 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 109.567 -0.531 . . . . 2.08 109.567 175.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.603 ' HA ' ' CE1' ' A' ' 64' ' ' PHE . 0.5 OUTLIER -52.88 -48.07 67.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.476 -0.784 . . . . 2.93 110.033 175.497 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.6 t60 -65.94 -53.03 44.49 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.721 -0.672 . . . . 1.21 111.315 -177.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -67.04 -41.65 86.17 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 111.961 0.356 . . . . 1.67 111.961 -172.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.99 -49.98 70.33 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.929 0.395 . . . . 1.48 110.315 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.776 HG13 HD22 ' A' ' 80' ' ' LEU . 35.0 t -57.74 -46.55 86.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.701 -0.681 . . . . 0.82 110.635 178.188 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -61.84 -40.24 94.62 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.611 -0.268 . . . . 1.14 111.583 -178.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 74.8 m -60.99 -51.22 70.17 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 111.626 0.232 . . . . 0.69 111.626 -177.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.615 HG12 ' HB2' ' A' ' 36' ' ' ALA . 2.7 mp -81.12 -48.84 18.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 CA-C-O 120.9 0.381 . . . . 0.77 111.295 -176.088 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.86 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.0 mp -69.8 -7.44 39.83 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 116.208 -0.451 . . . . 0.78 111.669 -176.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -55.51 -59.71 4.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.273 0.559 . . . . 1.93 109.951 171.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -68.64 -37.38 79.65 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.608 -0.724 . . . . 2.91 110.178 177.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.86 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 32.9 tt0 -55.27 -41.22 71.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.743 -0.662 . . . . 1.66 111.285 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.727 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 57.3 mt -54.84 -30.99 58.88 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 123.082 0.553 . . . . 0.58 112.402 179.426 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -60.2 -18.49 48.65 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.734 0.302 . . . . 0.92 111.3 -174.149 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.503 ' HB2' HD11 ' A' ' 29' ' ' ILE . 25.8 m-80 -101.8 4.86 40.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.815 0.34 . . . . 1.02 110.929 -178.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 3.3 mt -127.32 163.81 29.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 110.102 -0.332 . . . . 0.77 110.102 -175.344 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -96.55 -52.23 4.02 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.619 -0.511 . . . . 1.85 109.619 173.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -144.4 101.15 3.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.922 -0.581 . . . . 0.78 110.311 177.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -93.31 141.47 28.4 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.279 -0.419 . . . . 0.63 110.944 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.5 m -138.38 163.58 31.5 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.742 -0.836 . . . . 1.27 108.742 175.032 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -146.06 151.56 37.92 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.57 -0.452 . . . . 0.64 111.61 -178.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -113.81 116.32 29.16 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.56 -0.746 . . . . 2.23 109.481 176.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 42.5 t -84.23 124.19 30.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.71 0.29 . . . . 1.38 110.724 -177.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.666 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 2.1 t60 -147.99 152.72 37.95 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.868 -0.419 . . . . 1.98 109.868 179.122 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.489 HG21 ' HB2' ' A' ' 65' ' ' GLU . 0.8 OUTLIER -102.19 151.89 38.16 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-O 120.76 0.314 . . . . 0.76 111.838 178.113 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -59.36 -48.04 14.96 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.999 2.466 . . . . 0.72 112.247 -177.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.29 -36.12 81.13 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.83 -0.623 . . . . 2.08 111.199 -177.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.562 ' HA ' ' CE ' ' A' ' 102' ' ' LYS . 20.1 tp10 -75.72 -38.51 58.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.773 0.32 . . . . 2.69 110.627 -178.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -65.38 -33.25 75.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.871 0.367 . . . . 1.46 110.093 176.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -54.48 -43.75 72.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.578 -0.737 . . . . 1.23 111.591 178.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.562 ' CE ' ' HA ' ' A' ' 99' ' ' GLU . 0.0 OUTLIER -61.99 -47.78 83.29 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 120.899 -0.32 . . . . 2.66 110.708 177.72 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 62.4 mt -60.43 -46.42 90.1 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.181 -0.463 . . . . 1.31 111.309 -176.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -8.44 59.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.351 -0.386 . . . . 1.84 111.79 -177.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 35.8 t -67.04 -38.5 85.97 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.195 0.522 . . . . 2.05 110.267 179.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.408 ' HE3' ' HB3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -110.73 -41.55 4.26 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.856 -0.611 . . . . 4.02 110.581 178.399 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 98.88 51.06 1.42 Allowed Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.889 -0.672 . . . . 3.92 111.995 179.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 46.9 m . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.175 -0.917 . . . . 4.98 110.121 179.282 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 mmt . . . . . 0 N--CA 1.481 1.101 0 N-CA-C 110.09 -0.337 . . . . 36.14 110.09 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -97.28 -101.13 2.06 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.765 -0.731 . . . . 33.7 112.351 -179.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 47.3 m 63.96 22.23 12.9 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.279 0.562 . . . . 32.35 110.689 -178.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.1 m -88.51 114.6 25.3 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.707 -0.679 . . . . 30.38 111.575 -174.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 70.0 m-70 -102.15 39.69 1.45 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.108 0.48 . . . . 28.39 109.718 173.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -56.79 133.47 54.28 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.153 -0.931 . . . . 28.54 110.382 178.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -87.37 125.18 34.1 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.107 -0.497 . . . . 26.47 110.555 -178.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -107.42 107.65 18.63 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.851 -0.426 . . . . 24.34 109.851 176.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 41.1 p-80 -66.02 133.99 51.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.89 0.376 . . . . 23.8 110.741 178.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.6 p80 -134.41 144.62 48.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.959 -0.564 . . . . 20.9 110.132 -178.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.9 t -79.55 110.38 14.82 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.295 0.569 . . . . 19.89 110.954 -177.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.8 m -128.14 30.44 5.22 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.721 -0.672 . . . . 17.26 109.3 176.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -75.03 15.72 3.86 Favored Glycine 0 C--N 1.333 0.408 0 CA-C-N 115.593 -0.731 . . . . 16.67 114.043 -172.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 -90.76 -49.21 6.58 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.579 0.704 . . . . 19.13 109.94 175.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -91.15 30.2 1.28 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.015 -0.993 . . . . 14.57 111.399 -173.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -70.96 -15.46 62.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.272 0.558 . . . . 15.4 110.208 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 53.4 mt -82.31 -10.63 59.02 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.496 -0.775 . . . . 16.35 111.108 -177.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -98.38 156.18 16.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.918 0.389 . . . . 15.41 111.318 -175.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.2 p90 -116.12 -14.19 11.16 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.942 -0.572 . . . . 11.39 110.421 178.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 72.65 -61.66 0.49 Allowed 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.634 0.774 . . . . 10.77 112.191 177.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -150.61 -40.57 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.521 -0.847 . . . . 6.73 112.034 -178.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 -152.11 136.67 16.9 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.95 -0.759 . . . . 6.08 108.95 -179.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 66.6 mtt -64.8 107.72 1.54 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.514 -0.55 . . . . 4.41 109.514 178.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 34.7 m -60.78 159.74 10.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.827 -0.624 . . . . 1.71 110.814 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 9.3 tp -55.01 -34.15 30.89 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 CA-C-N 116.201 -0.454 . . . . 1.37 111.157 -178.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 21.2 tm0? -58.83 -47.4 84.94 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.593 -0.276 . . . . 1.75 110.317 177.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.573 ' HA ' ' HB3' ' A' ' 30' ' ' GLU . 53.1 mttt -71.74 -17.82 62.17 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 116.426 -0.352 . . . . 2.5 111.671 -178.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 95.3 t -67.25 -51.1 56.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 109.174 -0.676 . . . . 1.04 109.174 174.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.591 ' HA ' ' OE2' ' A' ' 83' ' ' GLU . 2.0 mp -61.29 -51.33 74.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 115.135 -0.939 . . . . 0.79 109.646 174.559 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.573 ' HB3' ' HA ' ' A' ' 27' ' ' LYS . 34.1 tt0 -53.06 -51.77 60.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.303 -0.862 . . . . 2.2 111.564 -178.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -61.87 -45.52 93.41 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.974 -0.557 . . . . 1.67 111.799 -174.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -68.42 -47.52 67.03 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.378 -0.529 . . . . 2.03 112.24 -175.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.486 HD12 ' N ' ' A' ' 34' ' ' SER . 4.2 pp -70.8 -27.69 64.08 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.095 -0.642 . . . . 0.57 110.987 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.486 ' N ' HD12 ' A' ' 33' ' ' LEU . 46.5 t -66.66 -46.34 76.03 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.937 -0.394 . . . . 1.29 109.937 175.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.8 m -71.35 -27.73 63.56 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.297 -0.41 . . . . 0.78 111.337 -179.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.61 -43.17 20.96 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.082 0.401 . . . . 0.64 112.082 -176.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 85.8 mt -104.46 -38.05 6.95 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.724 0.268 . . . . 0.94 111.724 -174.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.3 mttm 53.6 90.37 0.09 OUTLIER Pre-proline 0 N--CA 1.467 0.384 0 CA-C-O 121.647 0.737 . . . . 3.36 112.642 -175.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.75 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 5.2 Cg_endo -87.74 158.73 7.62 Favored 'Trans proline' 0 N--CA 1.451 -1.022 0 C-N-CA 123.155 2.57 . . . . 0.63 112.047 175.024 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 21.6 p -82.77 -26.19 32.08 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.742 0.782 . . . . 0.73 109.031 173.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.57 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 91.6 t80 -140.1 132.33 28.17 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.695 -1.139 . . . . 0.76 109.268 173.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.571 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 59.3 tp -136.18 122.64 20.74 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.941 -0.392 . . . . 1.55 109.941 -179.063 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.519 ' HB3' ' HB ' ' A' ' 58' ' ' VAL . 34.9 tt0 -119.88 119.86 34.75 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.432 -0.349 . . . . 2.23 110.061 -179.284 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -104.09 115.85 31.16 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.023 -0.362 . . . . 1.72 110.023 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 50.1 t -121.91 124.71 71.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.632 -0.258 . . . . 1.08 110.762 -178.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -82.07 122.63 28.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.113 0.482 . . . . 1.83 109.984 174.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -96.47 107.77 20.22 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.874 -0.603 . . . . 2.76 110.538 -178.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 36.4 m -79.92 27.93 0.29 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.822 -0.626 . . . . 3.2 111.408 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 17.0 t -78.57 99.15 6.4 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.039 -0.726 . . . . 4.74 109.039 178.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 109.83 -118.1 5.0 Favored Glycine 0 N--CA 1.445 -0.72 0 N-CA-C 110.913 -0.875 . . . . 3.16 110.913 -173.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 36.9 t -157.01 147.39 21.23 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.711 0.291 . . . . 4.36 110.478 177.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 104.52 -140.79 15.11 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 111.386 -0.685 . . . . 2.26 111.386 -178.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.7 t -136.82 134.47 37.0 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.386 0.612 . . . . 3.46 110.493 176.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.526 ' HB3' ' O ' ' A' ' 89' ' ' ALA . 68.6 m -146.29 135.95 23.19 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.501 -0.772 . . . . 1.71 108.969 179.675 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.463 ' HB2' ' CD1' ' A' ' 90' ' ' PHE . 81.2 m-85 -111.57 132.66 54.39 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.599 0.714 . . . . 1.15 111.385 -170.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -110.81 113.85 26.75 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 107.702 -1.221 . . . . 1.35 107.702 173.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.34 116.12 31.39 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.298 0.571 . . . . 0.51 111.382 -173.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.519 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 44.8 t -83.61 111.12 19.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 108.791 -0.818 . . . . 0.55 108.791 174.462 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.438 HG23 ' HA ' ' A' ' 94' ' ' CYS . 0.0 OUTLIER -110.14 107.84 23.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 121.876 0.846 . . . . 1.18 110.553 -176.207 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.57 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 94.4 t -107.72 108.01 24.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 114.86 -1.063 . . . . 0.58 109.013 176.253 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.75 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 45.2 t -151.36 154.78 37.35 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.254 0.549 . . . . 0.84 112.112 -173.175 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.491 ' O ' ' HB3' ' A' ' 65' ' ' GLU . 14.9 m120 -66.53 -19.44 65.78 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.233 -0.894 . . . . 1.67 110.27 174.126 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -64.69 -20.79 66.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.916 -0.584 . . . . 1.81 110.537 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -110.47 7.01 22.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.36 0.6 . . . . 3.19 110.042 178.103 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.491 ' HB3' ' O ' ' A' ' 62' ' ' ASN . 0.5 OUTLIER -76.69 -28.34 55.88 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 109.347 -0.612 . . . . 2.14 109.347 -177.008 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -71.72 -8.57 54.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.815 -0.63 . . . . 2.03 110.225 172.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 54.6 mttp 65.73 29.44 10.7 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.384 -0.826 . . . . 3.31 112.165 171.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.443 ' HB3' ' OD2' ' A' ' 71' ' ' ASP . 14.2 mmmm -90.71 96.11 10.48 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.024 0.44 . . . . 1.99 109.974 175.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.444 HD12 ' N ' ' A' ' 70' ' ' LEU . 3.8 pp -73.48 -36.77 65.86 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.98 -0.555 . . . . 2.33 111.521 -174.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.455 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.87 -32.26 72.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.717 0.294 . . . . 1.09 110.972 178.496 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.455 ' N ' HD22 ' A' ' 70' ' ' LEU . 4.1 m-20 -66.84 -49.39 65.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.914 0.388 . . . . 2.08 110.666 -179.533 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.43 ' HG3' ' O ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -66.08 -26.83 67.66 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.827 -0.349 . . . . 2.93 110.344 178.724 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -69.51 -50.03 49.01 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 116.278 -0.419 . . . . 1.21 111.001 -179.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 11.6 ptm180 -66.7 -36.31 82.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.66 -0.245 . . . . 1.67 111.169 -178.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.84 -50.59 55.83 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 120.711 0.291 . . . . 1.48 111.034 177.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.539 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 8.9 p -61.77 -35.4 67.43 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.298 0 CA-C-N 116.496 -0.32 . . . . 0.82 110.25 -179.087 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.601 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -69.62 -33.66 72.96 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.625 -0.261 . . . . 1.14 110.996 177.741 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 66.8 m -59.48 -51.72 68.66 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.707 0.289 . . . . 0.69 111.344 179.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.0 mp -83.18 -47.55 18.2 Favored 'Isoleucine or valine' 0 C--O 1.244 0.796 0 CA-C-O 121.681 0.753 . . . . 0.77 111.149 -177.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.805 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.3 mp -77.31 -0.45 25.54 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.176 -0.466 . . . . 0.78 112.121 -173.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.601 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 56.9 tptt -58.68 -57.77 11.54 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.26 -0.644 . . . . 1.93 109.26 171.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -72.15 -34.12 68.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.3 -0.863 . . . . 2.91 109.99 177.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.805 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 4.7 tp10 -54.86 -51.03 67.21 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.628 -0.714 . . . . 1.66 112.468 178.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.732 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 52.7 mt -50.35 -30.42 12.15 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.283 -0.871 . . . . 0.58 113.252 -176.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -53.73 -19.63 4.43 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.269 0.47 . . . . 0.92 112.269 -174.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -101.86 -4.0 27.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.77 0.319 . . . . 1.02 111.54 -177.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.498 HD11 HG12 ' A' ' 29' ' ' ILE . 12.6 mt -114.94 151.7 16.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.482 -0.326 . . . . 0.77 110.136 -174.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -84.99 -55.23 4.16 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.804 -0.358 . . . . 1.85 110.099 177.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.526 ' O ' ' HB3' ' A' ' 54' ' ' SER . . . -144.16 91.22 2.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.937 0.399 . . . . 0.78 111.185 178.292 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . 0.463 ' CD1' ' HB2' ' A' ' 55' ' ' PHE . 63.7 t80 -86.4 141.41 29.18 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.323 -0.399 . . . . 0.63 110.002 177.067 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 8.8 m -141.04 158.56 43.77 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.372 -0.603 . . . . 1.27 109.372 177.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -138.65 147.14 42.51 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.932 0.396 . . . . 0.64 111.124 -179.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -115.97 109.54 17.71 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.664 -0.698 . . . . 2.23 109.725 175.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.438 ' HA ' HG23 ' A' ' 59' ' ' ILE . 7.9 p -85.6 123.82 31.45 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.719 0.295 . . . . 1.38 110.623 -177.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.494 ' HD2' ' HG2' ' A' ' 99' ' ' GLU . 3.7 m80 -144.0 160.52 40.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.165 0.507 . . . . 1.98 110.99 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.424 ' CG2' ' HA ' ' A' ' 65' ' ' GLU . 11.5 p -102.75 153.69 38.03 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 115.489 -0.778 . . . . 0.76 111.132 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -58.12 -28.76 84.9 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.721 2.281 . . . . 0.72 111.69 175.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.53 -47.16 76.75 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.896 -0.593 . . . . 2.08 110.285 177.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.494 ' HG2' ' HD2' ' A' ' 95' ' ' HIS . 6.4 tp10 -67.05 -51.82 49.82 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.629 -0.714 . . . . 2.69 110.657 179.38 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -62.11 -32.39 72.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.917 -0.583 . . . . 1.46 110.966 -176.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.493 ' HA ' ' HE2' ' A' ' 104' ' ' LYS . 25.7 t70 -55.42 -33.24 63.37 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.035 -0.53 . . . . 1.23 111.072 178.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.42 ' N ' ' HE3' ' A' ' 102' ' ' LYS . 0.6 OUTLIER -76.55 -43.51 38.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.971 0.415 . . . . 2.66 110.223 176.8 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 86.2 mt -65.25 -49.57 69.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.799 -0.637 . . . . 1.31 111.492 -175.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.493 ' HE2' ' HA ' ' A' ' 101' ' ' ASP . 47.8 pttt -57.52 -25.3 59.66 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.193 -0.458 . . . . 1.84 111.694 -176.346 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.493 ' HB3' ' HD2' ' A' ' 106' ' ' LYS . 44.4 t -62.68 -20.66 65.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.847 -0.615 . . . . 2.05 111.391 -175.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.51 ' HB3' ' HE3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -144.74 -42.44 0.24 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.831 0.308 . . . . 4.02 111.831 -179.16 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 101.58 19.14 16.56 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.961 -0.638 . . . . 3.92 111.869 -178.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 10.0 t . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.453 -0.784 . . . . 4.98 109.738 -178.037 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.9 ptm . . . . . 0 N--CA 1.48 1.05 0 CA-C-O 120.654 0.264 . . . . 36.14 110.445 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 77.93 -89.62 1.07 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 121.009 -0.615 . . . . 33.7 112.784 175.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -71.0 123.9 23.12 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.544 0.211 . . . . 32.35 110.616 -178.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.6 t -155.07 137.92 15.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.195 0.521 . . . . 30.38 111.167 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 7.7 t-160 -158.03 109.58 2.26 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 107.633 -1.247 . . . . 28.39 107.633 174.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.556 ' HA ' ' O ' ' A' ' 104' ' ' LYS . 93.9 m-70 -62.02 109.28 1.23 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.471 0.653 . . . . 28.54 112.156 -168.494 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.57 ' HB2' ' HB2' ' A' ' 104' ' ' LYS . 24.0 m170 -134.42 168.49 18.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.565 -1.198 . . . . 26.47 109.678 179.626 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 15.8 p80 -116.11 177.8 4.55 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.523 -0.917 . . . . 24.34 108.523 171.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 57.8 m170 -59.86 120.9 10.47 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.269 -1.012 . . . . 23.8 108.269 174.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -63.5 -16.36 60.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.864 -0.607 . . . . 20.9 111.852 -166.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.9 m 64.64 30.23 12.69 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.462 0.649 . . . . 19.89 110.506 177.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.624 ' HA ' ' NH1' ' A' ' 14' ' ' ARG . 32.3 m -100.16 165.3 11.57 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.247 -0.888 . . . . 17.26 109.819 177.136 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 163.28 -15.13 0.11 Allowed Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.486 -0.864 . . . . 16.67 113.279 -178.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.624 ' NH1' ' HA ' ' A' ' 12' ' ' SER . 0.5 OUTLIER -107.88 -19.31 13.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 117.676 0.738 . . . . 19.13 111.314 -177.183 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.476 ' OE2' ' HD2' ' A' ' 14' ' ' ARG . 1.2 pm0 -87.66 13.76 9.79 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.608 -0.269 . . . . 14.57 111.602 -176.052 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -76.92 -11.04 59.76 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.368 -0.604 . . . . 15.4 109.368 174.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.7 mp -91.8 -0.95 57.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.43 -0.804 . . . . 16.35 110.031 175.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.441 ' HB3' HE22 ' A' ' 20' ' ' GLN . 84.4 m-85 -120.47 93.03 3.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.237 0.542 . . . . 15.41 111.521 -175.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.425 ' HZ ' ' HG3' ' A' ' 27' ' ' LYS . 28.0 t80 -111.34 81.32 1.42 Allowed 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.423 -0.808 . . . . 11.39 109.935 176.097 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.441 HE22 ' HB3' ' A' ' 18' ' ' TYR . 0.8 OUTLIER -141.06 132.57 26.96 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.008 -0.542 . . . . 10.77 110.671 179.019 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -176.0 -78.54 0.05 OUTLIER Glycine 0 N--CA 1.446 -0.652 0 CA-C-N 115.67 -0.695 . . . . 6.73 111.375 178.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -148.92 138.29 21.71 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.78 -0.452 . . . . 6.08 109.78 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 84.1 mtp -94.96 127.7 41.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.199 0.524 . . . . 4.41 110.845 -179.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.509 ' O ' HG23 ' A' ' 28' ' ' VAL . 42.4 t -155.84 150.72 26.32 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.646 -0.872 . . . . 1.71 108.646 176.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.552 ' O ' HG12 ' A' ' 29' ' ' ILE . 8.7 tp -53.07 -38.2 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 O-C-N 123.501 0.501 . . . . 1.37 111.626 -175.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -62.01 -52.26 64.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.807 0.337 . . . . 1.75 110.614 179.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.425 ' HG3' ' HZ ' ' A' ' 19' ' ' PHE . 17.4 tppt? -64.97 -31.45 72.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.101 -0.5 . . . . 2.5 110.774 -178.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 24' ' ' CYS . 89.5 t -61.79 -46.45 96.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 110.125 -0.324 . . . . 1.04 110.125 175.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.599 HG21 HD11 ' A' ' 87' ' ' ILE . 51.3 mm -63.14 -43.07 98.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.132 -0.486 . . . . 0.79 110.342 177.283 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -54.18 -51.94 62.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.982 -0.553 . . . . 2.2 111.005 177.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.418 ' HA ' ' HG ' ' A' ' 34' ' ' SER . 16.5 t70 -67.65 -34.55 77.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.183 0.516 . . . . 1.67 111.007 -179.55 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.541 ' HG2' ' OE1' ' A' ' 83' ' ' GLU . 13.5 tptp -60.18 -55.89 28.31 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.517 -0.765 . . . . 2.03 111.388 -177.423 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.5 pp -74.16 -29.76 61.93 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.984 -0.286 . . . . 0.57 111.722 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.418 ' HG ' ' HA ' ' A' ' 31' ' ' ASP . 73.6 p -72.04 -33.4 67.97 Favored 'General case' 0 C--O 1.224 -0.248 0 C-N-CA 121.089 -0.244 . . . . 1.29 111.241 -177.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.2 m -65.79 -27.32 68.19 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.826 0.346 . . . . 0.78 111.042 176.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.29 -49.47 6.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.385 -0.37 . . . . 0.64 111.672 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.6 mt -83.11 -30.15 28.16 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.855 0.317 . . . . 0.94 111.855 -177.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 16.3 mmtm 55.68 81.82 0.25 Allowed Pre-proline 0 N--CA 1.466 0.329 0 C-N-CA 123.175 0.59 . . . . 3.36 112.331 -176.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.589 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 69.0 Cg_endo -92.62 139.23 1.81 Allowed 'Trans proline' 0 N--CA 1.448 -1.195 0 C-N-CA 122.887 2.392 . . . . 0.63 111.947 174.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 13.7 p -68.41 -32.5 72.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.22 0.533 . . . . 0.73 110.298 176.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.502 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 69.1 t80 -141.97 131.76 24.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.491 -0.777 . . . . 0.76 109.472 176.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.7 tp -141.87 112.87 7.41 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.756 0.312 . . . . 1.55 110.535 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -125.74 139.17 53.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.493 -0.321 . . . . 2.23 110.322 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.5 ' HG ' ' HB2' ' A' ' 57' ' ' ALA . 7.2 mp -117.12 122.41 44.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.541 -0.3 . . . . 1.72 110.497 -178.434 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.507 HG23 ' HB3' ' A' ' 56' ' ' ASP . 9.6 m -112.75 150.79 14.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.017 0.437 . . . . 1.08 111.135 178.115 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -78.28 119.58 21.84 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.793 -0.64 . . . . 1.83 110.235 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 21.5 ttmm -100.16 124.91 46.13 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.223 -0.444 . . . . 2.76 109.862 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.2 p -79.43 106.42 11.44 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.194 -0.457 . . . . 3.2 111.284 -177.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 49.7 t -113.86 15.51 18.58 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.337 0.589 . . . . 4.74 109.692 176.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 81.11 -111.63 3.33 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.831 -0.699 . . . . 3.16 111.585 -177.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 40.4 t -88.26 101.34 13.76 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.169 -0.678 . . . . 4.36 109.169 174.169 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 127.92 99.79 1.02 Allowed Glycine 0 N--CA 1.446 -0.683 0 N-CA-C 110.811 -0.915 . . . . 2.26 110.811 -174.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.1 p -78.17 99.93 6.41 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.01 0.433 . . . . 3.46 111.322 -176.21 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.0 p -87.81 144.2 26.73 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.997 -0.547 . . . . 1.71 110.711 178.298 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -111.63 132.74 54.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.415 -0.357 . . . . 1.15 110.621 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.507 ' HB3' HG23 ' A' ' 45' ' ' VAL . 5.2 t70 -107.76 110.37 22.17 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.33 -0.619 . . . . 1.35 109.33 179.08 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.5 ' HB2' ' HG ' ' A' ' 44' ' ' LEU . . . -106.17 115.8 30.84 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.99 0.424 . . . . 0.51 111.315 -177.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 56.2 t -82.02 111.18 18.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.81 -0.632 . . . . 0.55 109.32 175.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.431 HG12 ' HB3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -104.41 108.8 25.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.667 0.746 . . . . 1.18 110.13 -176.971 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.612 ' HA ' ' O ' ' A' ' 95' ' ' HIS . 60.4 t -106.5 106.67 21.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.175 -0.92 . . . . 0.58 109.27 177.13 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.589 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 30.0 t -142.31 147.93 37.17 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.012 0.434 . . . . 0.84 112.081 -174.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.626 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 25.0 m120 -67.13 -20.68 65.8 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.5 -0.773 . . . . 1.67 110.891 174.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -61.51 -23.96 66.28 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.939 -0.573 . . . . 1.81 111.154 -177.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -100.65 -5.3 26.82 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.476 -0.329 . . . . 3.19 111.477 -175.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.626 ' HG2' ' O ' ' A' ' 62' ' ' ASN . 7.7 pt-20 -77.58 -2.17 34.42 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 120.401 -0.52 . . . . 2.14 111.457 -174.11 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -92.86 4.49 53.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.227 0.536 . . . . 2.03 109.939 176.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt 71.82 15.21 5.85 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.18 -0.918 . . . . 3.31 111.062 175.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.427 ' HB3' ' HB3' ' A' ' 71' ' ' ASP . 44.0 mmtm -76.39 89.7 3.21 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.195 0.522 . . . . 1.99 110.963 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -73.92 -50.01 22.09 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.609 -0.723 . . . . 2.33 109.899 179.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.521 HD22 ' N ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -67.61 -34.58 77.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.117 -0.492 . . . . 1.09 111.215 -175.754 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.521 ' N ' HD22 ' A' ' 70' ' ' LEU . 9.4 t70 -73.76 -37.03 65.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.316 0.579 . . . . 2.08 109.878 -178.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.425 ' O ' HG23 ' A' ' 76' ' ' VAL . 1.3 tmt_? -63.42 -41.88 98.71 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.752 -0.658 . . . . 2.93 110.018 172.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -63.02 -47.01 84.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.089 -0.505 . . . . 1.21 111.155 -178.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 3.5 ptm180 -66.18 -35.66 81.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.466 -0.334 . . . . 1.67 110.963 -177.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.84 -48.34 71.96 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 110.244 -0.28 . . . . 1.48 110.244 176.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.531 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 64.6 t -56.92 -42.49 78.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.083 -0.508 . . . . 0.82 110.678 177.292 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.407 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 0.9 OUTLIER -64.91 -42.95 94.31 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.989 -0.284 . . . . 1.14 111.548 179.286 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 57.4 m -65.92 -49.09 69.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.03 0.443 . . . . 0.69 111.349 -176.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.428 ' HB ' HD12 ' A' ' 80' ' ' LEU . 35.1 mt -72.4 -53.37 19.66 Favored 'Isoleucine or valine' 0 C--O 1.241 0.643 0 CA-C-O 121.742 0.782 . . . . 0.77 110.708 -178.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 1.053 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 8.4 mp -79.57 -0.31 33.05 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.175 -0.92 . . . . 0.78 111.965 -172.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 17.8 tppt? -53.81 -63.92 0.99 Allowed 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.475 -0.49 . . . . 1.93 109.688 173.066 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -75.76 -33.08 60.21 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.096 -0.502 . . . . 2.91 110.884 173.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 1.053 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 1.8 tp10 -52.83 -52.88 55.35 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.787 0.327 . . . . 1.66 111.683 -177.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 61.9 mt -50.49 -30.83 13.71 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.48 -0.782 . . . . 0.58 112.465 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -57.81 -22.38 47.15 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 120.745 0.307 . . . . 0.92 111.077 -177.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -90.47 -7.01 54.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.811 0.338 . . . . 1.02 111.174 -178.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.599 HD11 HG21 ' A' ' 29' ' ' ILE . 6.9 mt -123.72 135.45 63.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.504 -0.316 . . . . 0.77 110.498 -174.283 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -69.33 -46.74 66.34 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.561 -0.533 . . . . 1.85 109.561 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -151.94 101.36 2.73 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.239 -0.437 . . . . 0.78 110.947 178.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . 0.506 ' HB2' HG21 ' A' ' 87' ' ' ILE . 79.1 t80 -103.01 139.28 38.77 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.944 0.402 . . . . 0.63 111.028 178.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.7 m -135.19 149.49 49.94 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.32 -0.622 . . . . 1.27 109.32 174.45 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -134.42 134.23 41.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.106 0.479 . . . . 0.64 111.105 -178.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -106.48 116.74 32.46 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.805 -0.634 . . . . 2.23 109.377 177.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 7.2 p -83.62 129.39 34.96 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.016 0.436 . . . . 1.38 111.613 -175.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.612 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 0.1 OUTLIER -145.09 158.23 43.88 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.802 -0.636 . . . . 1.98 109.67 176.063 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.403 ' HA ' ' HD3' ' A' ' 97' ' ' PRO . 0.6 OUTLIER -112.03 153.99 44.39 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 116.413 -0.358 . . . . 0.76 111.627 -178.507 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 96' ' ' THR . 27.5 Cg_exo -61.89 -26.86 79.48 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 123.11 2.54 . . . . 0.72 112.724 -176.241 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 98' ' ' LEU . 1.2 tm? -62.45 -51.41 67.62 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.777 -0.453 . . . . 2.08 109.777 -178.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.563 ' O ' ' HG ' ' A' ' 103' ' ' LEU . 6.4 mp0 -66.82 -38.8 87.17 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.38 -0.373 . . . . 2.69 111.0 177.168 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -59.42 -39.72 84.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.586 -0.279 . . . . 1.46 111.05 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.531 ' HA ' ' HE3' ' A' ' 104' ' ' LYS . 24.9 t70 -58.46 -34.43 70.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 1.23 110.524 179.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.703 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.6 OUTLIER -76.44 -35.47 58.48 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.399 -0.364 . . . . 2.66 110.537 178.455 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.563 ' HG ' ' O ' ' A' ' 99' ' ' GLU . 69.8 mt -65.69 -46.68 78.11 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.94 -0.573 . . . . 1.31 111.396 -178.109 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.57 ' HB2' ' HB2' ' A' ' 7' ' ' HIS . 0.1 OUTLIER -77.8 -21.9 50.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 1.84 111.973 -176.339 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.42 ' N ' ' HD2' ' A' ' 104' ' ' LYS . 41.9 m -82.78 -60.66 2.1 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.995 0.426 . . . . 2.05 110.919 179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.462 ' HE3' ' OXT' ' A' ' 108' ' ' SER . 44.6 pttt -114.09 -56.83 2.35 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.11 -0.495 . . . . 4.02 110.824 -175.032 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 123.89 -30.9 4.71 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 121.075 -0.583 . . . . 3.92 112.027 -179.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.462 ' OXT' ' HE3' ' A' ' 106' ' ' LYS . 52.7 p . . . . . 0 C--O 1.251 1.179 0 CA-C-O 118.573 -0.727 . . . . 4.98 110.761 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.3 mtt . . . . . 0 N--CA 1.48 1.065 0 CA-C-O 120.936 0.398 . . . . 36.14 110.194 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 139.54 -159.6 25.85 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 111.327 -0.709 . . . . 33.7 111.327 -177.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.3 t -88.3 89.8 8.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.09 0.472 . . . . 32.35 110.328 178.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.0 m -69.93 134.11 48.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.017 -0.538 . . . . 30.38 109.786 174.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -77.89 123.1 26.35 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.888 0.375 . . . . 28.39 111.215 -176.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 35.4 m80 -71.78 93.98 1.35 Allowed 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.465 -0.569 . . . . 28.54 109.465 177.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 5.1 p80 -79.38 91.32 5.06 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.694 0.759 . . . . 26.47 110.975 -177.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 35.4 t-80 -75.51 93.06 2.94 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.355 -0.839 . . . . 24.34 109.613 176.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 28.4 p80 -59.11 141.2 54.74 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.9 -0.591 . . . . 23.8 111.604 -178.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 44.1 p-80 -127.98 144.87 51.11 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.967 -0.753 . . . . 20.9 108.967 175.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.5 m -70.07 139.82 52.67 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.624 0.25 . . . . 19.89 110.546 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 43.3 m -73.61 85.41 1.59 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.46 0.647 . . . . 17.26 110.001 176.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -172.34 61.62 0.15 Allowed Glycine 0 N--CA 1.445 -0.718 0 CA-C-N 115.041 -0.981 . . . . 16.67 110.671 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -108.37 -34.55 6.76 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.441 0.639 . . . . 19.13 109.647 -175.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.493 ' CD ' ' H ' ' A' ' 15' ' ' GLU . 0.6 OUTLIER -91.21 1.01 57.42 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.154 -0.93 . . . . 14.57 111.066 -178.886 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.505 ' ND2' HD12 ' A' ' 17' ' ' LEU . 0.2 OUTLIER -72.22 -1.51 15.44 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.798 0.332 . . . . 15.4 111.596 -178.162 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.505 HD12 ' ND2' ' A' ' 16' ' ' ASN . 6.9 mp -80.88 -17.84 49.28 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.046 0.451 . . . . 16.35 110.31 174.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -89.79 91.82 8.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.166 0.508 . . . . 15.41 111.069 -178.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -106.62 9.51 31.33 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.688 -0.687 . . . . 11.39 109.738 176.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -74.25 -7.97 54.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.209 -0.905 . . . . 10.77 110.813 179.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -68.51 101.94 0.82 Allowed Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.956 -0.64 . . . . 6.73 111.971 179.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 60.8 m80 -84.15 170.69 13.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.675 0.274 . . . . 6.08 110.417 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 48.3 tpp -66.95 96.31 0.42 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.892 -0.595 . . . . 4.41 110.381 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 37.8 m -84.41 143.27 29.54 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.852 -0.613 . . . . 1.71 109.788 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 11.2 tp -61.24 -32.03 51.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.611 0.243 . . . . 1.37 110.899 -176.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.461 ' HA ' ' OE1' ' A' ' 26' ' ' GLN . 6.4 tp60 -63.14 -37.2 86.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.97 0.414 . . . . 1.75 110.683 179.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -71.59 -33.8 69.33 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.226 -0.443 . . . . 2.5 110.054 177.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.43 HG12 ' HE3' ' A' ' 32' ' ' LYS . 62.2 t -61.45 -50.91 78.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.968 -0.56 . . . . 1.04 110.194 177.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.483 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.7 mp -58.39 -50.21 79.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.804 -0.635 . . . . 0.79 110.149 176.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -53.46 -52.03 60.81 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.727 -0.669 . . . . 2.2 111.579 -178.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -68.8 -42.22 77.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 1.67 112.138 -173.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.43 ' HE3' HG12 ' A' ' 28' ' ' VAL . 8.4 mtmp? -66.88 -45.71 77.19 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.595 -0.442 . . . . 2.03 111.564 -175.127 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 4.5 pp -72.31 -28.27 62.97 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.197 -0.601 . . . . 0.57 110.999 177.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.443 ' N ' HD12 ' A' ' 33' ' ' LEU . 46.3 t -66.0 -41.82 90.56 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.982 0.42 . . . . 1.29 109.901 175.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.7 m -66.93 -27.65 67.65 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.111 0.482 . . . . 0.78 110.686 179.021 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.496 ' HB2' HG12 ' A' ' 79' ' ' ILE . . . -77.15 -53.91 7.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.807 -0.633 . . . . 0.64 111.87 -178.613 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.3 mt -86.79 -26.38 24.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.439 -0.346 . . . . 0.94 111.465 -174.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.2 tttp 56.67 75.12 0.6 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.771 -0.65 . . . . 3.36 110.964 -176.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.539 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 23.5 Cg_endo -94.45 144.47 1.66 Allowed 'Trans proline' 0 N--CA 1.448 -1.154 0 C-N-CA 123.29 2.66 . . . . 0.63 112.566 179.141 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 23.9 p -80.58 -23.76 39.66 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.424 0.63 . . . . 0.73 109.489 174.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.775 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 76.5 t80 -139.25 125.21 19.81 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.005 -0.998 . . . . 0.76 109.248 175.272 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -142.23 118.73 10.94 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.323 -0.621 . . . . 1.55 109.323 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -131.55 131.89 43.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.518 -0.31 . . . . 2.23 110.908 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -89.55 115.59 27.07 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.975 -0.75 . . . . 1.72 108.975 176.004 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 44.6 t -107.17 132.21 55.19 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.024 0.44 . . . . 1.08 111.502 -175.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.28 100.93 0.38 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.515 -0.766 . . . . 1.83 109.255 172.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.515 ' HD3' ' HB3' ' A' ' 56' ' ' ASP . 27.4 tptt -89.69 -69.01 0.74 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.013 0.435 . . . . 2.76 109.985 -176.002 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 16.8 t -82.91 112.07 19.37 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.769 -0.65 . . . . 3.2 109.653 -179.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.0 p -65.19 129.25 39.03 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.251 0.548 . . . . 4.74 111.169 -176.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 155.13 -138.89 6.32 Favored Glycine 0 N--CA 1.444 -0.767 0 CA-C-N 115.207 -0.906 . . . . 3.16 111.205 -177.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.5 t -86.79 -14.46 42.2 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.022 0.439 . . . . 4.36 110.08 177.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 128.77 55.43 0.11 Allowed Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.845 -0.693 . . . . 2.26 111.913 178.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.4 m -68.52 -42.07 79.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.214 0.531 . . . . 3.46 110.912 -179.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.0 m -140.01 127.24 21.16 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.79 -0.641 . . . . 1.71 110.142 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -111.55 132.42 54.54 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.719 -0.845 . . . . 1.15 108.719 175.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.515 ' HB3' ' HD3' ' A' ' 47' ' ' LYS . 35.1 t70 -115.56 125.94 53.6 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.947 -0.39 . . . . 1.35 109.947 -175.183 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -106.15 115.95 31.1 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.199 0.523 . . . . 0.51 111.273 -174.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 62.0 t -78.09 111.85 15.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.391 -0.822 . . . . 0.55 109.061 174.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.543 ' CG1' ' HA ' ' A' ' 94' ' ' CYS . 0.9 OUTLIER -105.16 133.89 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-O 121.234 0.54 . . . . 1.18 110.356 -177.559 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.775 ' HB ' ' HB3' ' A' ' 41' ' ' PHE . 96.9 t -124.91 101.48 8.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 N-CA-C 108.618 -0.882 . . . . 0.58 108.618 172.125 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.539 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 37.1 t -151.7 154.97 37.37 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.186 -0.461 . . . . 0.84 111.376 -173.211 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.46 -18.97 65.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.935 -0.575 . . . . 1.67 110.519 174.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -63.42 -1.93 1.34 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 122.804 0.442 . . . . 1.81 112.022 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.594 ' HD2' HG23 ' A' ' 96' ' ' THR . 51.6 t80 -109.69 -7.14 15.12 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.983 -0.448 . . . . 3.19 111.528 179.643 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -75.5 -18.2 59.9 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.688 -0.405 . . . . 2.14 111.606 -171.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.5 ' O ' ' HG2' ' A' ' 67' ' ' LYS . 8.7 m-20 -75.59 -15.41 60.36 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.828 -0.169 . . . . 2.03 110.847 175.49 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 66' ' ' ASP . 62.3 pttt 53.6 13.85 0.53 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.759 1.224 . . . . 3.31 113.21 178.482 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -78.82 125.32 29.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.209 0.528 . . . . 1.99 111.276 179.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 28.0 tp -69.7 -56.67 6.57 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.311 -0.858 . . . . 2.33 111.1 -179.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.98 -31.16 72.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.717 -0.674 . . . . 1.09 112.125 -171.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.418 ' O ' ' HG2' ' A' ' 74' ' ' ARG . 12.4 t70 -73.76 -45.46 51.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.056 0.455 . . . . 2.08 110.636 -174.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 72' ' ' ARG . 12.9 ptt180 -72.49 -31.78 65.65 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.658 -0.497 . . . . 2.93 109.658 178.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -60.67 -50.93 71.54 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.086 -0.506 . . . . 1.21 110.349 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.418 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 6.2 ptm180 -63.88 -40.46 96.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.52 -0.309 . . . . 1.67 111.23 -178.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 71' ' ' ASP . 89.0 mt -65.09 -50.24 66.89 Favored 'General case' 0 C--O 1.243 0.715 0 CA-C-O 121.122 0.486 . . . . 1.48 110.754 179.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.538 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 47.1 t -55.65 -45.34 78.99 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.586 0 CA-C-N 115.494 -0.776 . . . . 0.82 110.568 178.093 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.405 ' O ' ' HB2' ' A' ' 81' ' ' LYS . 12.7 m120 -66.96 -27.37 67.4 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 121.007 -0.277 . . . . 1.14 111.431 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 96.4 m -63.19 -54.02 44.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.541 0.21 . . . . 0.69 110.943 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.496 HG12 ' HB2' ' A' ' 36' ' ' ALA . 3.3 mp -82.19 -42.29 18.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 CA-C-O 121.63 0.728 . . . . 0.77 111.006 -178.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.878 ' HA ' ' HB3' ' A' ' 83' ' ' GLU . 10.5 mp -76.49 -0.99 25.04 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.041 -0.527 . . . . 0.78 111.757 -176.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 77' ' ' ASN . 51.5 tptt -51.56 -63.37 1.15 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.379 -0.6 . . . . 1.93 109.379 169.503 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -74.63 -34.9 62.88 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.162 -0.472 . . . . 2.91 110.989 176.3 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.878 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 5.5 tp10 -52.55 -55.4 22.48 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.387 0.613 . . . . 1.66 111.975 -178.537 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 65.8 mt -50.51 -30.87 13.92 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 115.174 -0.921 . . . . 0.58 112.756 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -56.64 -23.15 39.37 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.901 0.381 . . . . 0.92 111.098 -176.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -96.54 -1.19 47.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.132 -0.485 . . . . 1.02 111.447 -176.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 6.9 mt -127.78 142.32 44.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 110.409 -0.219 . . . . 0.77 110.409 -177.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 86.0 t60 -69.98 -56.8 6.04 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.657 -0.417 . . . . 1.85 110.029 175.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -143.07 104.09 4.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.119 -0.491 . . . . 0.78 110.533 179.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -92.15 133.27 35.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.15 0.5 . . . . 0.63 110.811 177.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 42.5 t -121.04 155.73 33.73 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.178 -0.675 . . . . 1.27 109.178 177.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -143.51 138.97 29.57 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.867 0.365 . . . . 0.64 110.585 -177.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -112.47 109.06 18.43 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.562 -0.533 . . . . 2.23 109.562 174.565 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.543 ' HA ' ' CG1' ' A' ' 59' ' ' ILE . 37.6 m -84.01 111.65 19.48 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.829 -0.623 . . . . 1.38 110.863 -174.256 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -132.05 157.69 43.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.091 0.472 . . . . 1.98 111.063 177.041 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.594 HG23 ' HD2' ' A' ' 64' ' ' PHE . 48.0 p -102.52 159.54 29.04 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.174 -0.467 . . . . 0.76 110.339 176.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.536 ' HG2' HD22 ' A' ' 98' ' ' LEU . 18.3 Cg_endo -60.71 -37.26 80.28 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.582 2.188 . . . . 0.72 111.928 177.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.536 HD22 ' HG2' ' A' ' 97' ' ' PRO . 2.9 mm? -69.67 -32.64 71.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.109 -0.496 . . . . 2.08 110.362 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 76.6 tt0 -72.17 -50.8 24.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.086 0.47 . . . . 2.69 110.028 177.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.526 ' O ' ' HG2' ' A' ' 104' ' ' LYS . 82.6 t80 -62.94 -35.21 79.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.762 -0.654 . . . . 1.46 111.607 -176.524 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.538 ' HA ' ' HD3' ' A' ' 104' ' ' LYS . 37.2 t70 -60.74 -33.0 72.26 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.873 0.368 . . . . 1.23 111.372 -178.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.639 ' N ' ' HE2' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -78.18 -22.54 48.48 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.851 0.357 . . . . 2.66 110.638 177.729 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.502 ' O ' ' HG3' ' A' ' 106' ' ' LYS . 91.2 mt -78.66 -42.81 27.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.204 -0.453 . . . . 1.31 111.092 -178.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.538 ' HD3' ' HA ' ' A' ' 101' ' ' ASP . 3.2 ptmt -61.62 -34.99 76.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.453 -0.34 . . . . 1.84 111.503 179.183 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.8 m -63.48 -40.61 97.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.418 -0.356 . . . . 2.05 111.348 -178.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.502 ' HG3' ' O ' ' A' ' 103' ' ' LEU . 5.9 ptpt -86.64 -41.16 14.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.889 0.376 . . . . 4.02 111.372 -179.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 87.39 -32.35 4.19 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.914 -0.66 . . . . 3.92 112.482 179.271 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 49.5 m . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.61 -0.71 . . . . 4.98 110.203 179.618 . . . . . . . . 0 0 . 1 stop_ save_