data_2f3v_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 2f3v _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 ' 6' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.86 0.362 . . . . 0.0 110.669 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.412 ' CD1' ' CD ' ' A' ' 9' ' ' LYS . 1.5 pp -87.8 120.34 29.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.115 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -81.39 88.8 6.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.515 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.474 ' HG2' ' CG1' ' A' ' 74' ' ' VAL . 1.8 tttt -88.11 159.45 18.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.409 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.16 165.39 13.69 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.202 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.473 ' HB3' ' CG ' ' A' ' 73' ' ' GLU . 93.2 Cg_endo -77.55 163.14 29.81 Favored 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.347 2.031 . . . . 0.0 112.289 -178.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.428 ' CB ' ' HB3' ' A' ' 25' ' ' LEU . . . -115.56 -165.38 1.03 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.13 0.491 . . . . 0.0 111.716 -179.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.5 p -116.36 -174.89 2.64 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.06 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 61.1 tp -98.34 113.86 25.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.814 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 22.4 mm -125.18 -43.88 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.914 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -142.12 141.54 32.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.716 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -127.01 119.32 26.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.153 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.472 HD12 HG21 ' A' ' 18' ' ' ILE . 23.7 mt -150.61 152.88 11.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.096 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -68.6 76.8 0.29 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.893 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 48.51 74.05 0.29 Allowed Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.529 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -147.8 -48.7 0.17 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.129 0.49 . . . . 0.0 110.575 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 t -169.87 106.57 0.35 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.676 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.426 ' O ' ' HA ' ' A' ' 33' ' ' THR . 41.5 t -127.24 113.42 32.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.526 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.38 127.47 32.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.264 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.428 ' HB3' ' CB ' ' A' ' 12' ' ' ALA . 7.1 mp -114.6 139.06 49.92 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.334 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.86 99.39 2.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.914 0.388 . . . . 0.0 110.793 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -116.36 115.39 25.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.751 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.3 ttmp? 63.84 25.23 13.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.013 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 93.88 -13.97 66.29 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.642 -0.789 . . . . 0.0 112.884 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -112.3 139.45 22.55 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.835 0.318 . . . . 0.0 111.011 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -79.21 139.02 14.61 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.684 2.256 . . . . 0.0 112.419 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.469 ' CB ' ' CZ ' ' A' ' 34' ' ' PHE . 3.1 mmt -139.34 128.22 23.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.935 0.397 . . . . 0.0 111.029 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.426 ' HA ' ' O ' ' A' ' 23' ' ' VAL . 86.7 m -79.31 127.8 32.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.905 -179.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.627 ' HB3' ' CB ' ' A' ' 90' ' ' ALA . 38.0 m-85 -141.33 130.92 23.98 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.45 179.083 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -143.33 96.26 2.89 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.608 ' O ' ' CD1' ' A' ' 91' ' ' TYR . 0.2 OUTLIER -144.34 87.29 1.87 Allowed 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.364 177.497 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -145.71 103.9 3.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.931 0.396 . . . . 0.0 111.267 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 55.9 mt . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.006 -179.857 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.418 ' HA ' ' CD2' ' A' ' 61' ' ' PHE . . . . . . . . 0 N--CA 1.462 0.142 0 CA-C-O 120.84 0.352 . . . . 0.0 111.412 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.2 p -54.0 -22.14 9.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.545 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -86.02 -31.2 22.13 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.861 0.362 . . . . 0.0 110.768 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.484 ' CA ' ' HB2' ' A' ' 65' ' ' MET . 19.0 m-30 -55.56 -30.59 61.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.743 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.555 ' HA ' ' HB2' ' A' ' 66' ' ' TRP . 0.0 OUTLIER -63.68 -14.79 55.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.549 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.7 mtpt -90.94 -68.36 0.8 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.139 0.495 . . . . 0.0 111.418 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.1 mttt -87.96 -51.49 5.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.084 -179.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.489 ' O ' ' O ' ' A' ' 69' ' ' ALA . 2.1 mmt -63.63 -13.98 47.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.568 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . 0.555 ' HB2' ' HA ' ' A' ' 62' ' ' THR . 18.8 t90 -83.56 -34.96 25.09 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 121.392 0.615 . . . . 0.0 109.668 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -94.34 -22.99 17.99 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.118 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -114.1 -28.15 7.42 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.489 ' O ' ' O ' ' A' ' 65' ' ' MET . . . -108.22 154.66 21.44 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.39 -178.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.473 ' O ' ' N ' ' A' ' 95' ' ' ASP . 0.0 OUTLIER -51.24 100.45 0.03 OUTLIER 'General case' 0 C--O 1.225 -0.188 0 CA-C-O 122.059 0.933 . . . . 0.0 108.676 -179.828 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.528 ' HB3' ' HA ' ' A' ' 66' ' ' TRP . 0.0 OUTLIER -84.97 174.41 9.79 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.312 -1.313 . . . . 0.0 114.019 -176.377 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.544 HG21 ' N ' ' A' ' 93' ' ' TYR . 23.1 pt -63.96 141.05 18.69 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.21 0 CA-C-O 122.278 1.037 . . . . 0.0 113.757 -175.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.473 ' CG ' ' HB3' ' A' ' 11' ' ' PRO . 41.2 mt-10 -158.78 157.57 31.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 113.371 -1.741 . . . . 0.0 107.927 179.46 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.474 ' CG1' ' HG2' ' A' ' 9' ' ' LYS . 1.7 p -100.85 145.12 11.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.359 -0.536 . . . . 0.0 111.073 -179.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.414 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -125.79 -69.25 0.79 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.534 -179.197 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.414 ' CD1' ' HB3' ' A' ' 75' ' ' GLU . 12.6 p90 -138.67 156.4 47.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.947 0.403 . . . . 0.0 111.236 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -104.03 158.47 16.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.823 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.9 tptt -87.42 -40.72 14.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.044 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 106.02 26.46 6.04 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.573 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -118.56 -40.47 2.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.907 0.384 . . . . 0.0 110.701 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.505 ' HG3' ' N ' ' A' ' 82' ' ' THR . 0.0 OUTLIER 80.04 -54.76 0.38 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.191 179.848 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.505 ' N ' ' HG3' ' A' ' 81' ' ' ARG . 1.3 t -110.04 120.61 43.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.651 0.262 . . . . 0.0 111.078 179.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -115.54 -51.58 2.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.261 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.34 -63.22 1.41 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.195 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -103.51 -35.2 8.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.898 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . 0.459 ' HA2' ' CB ' ' A' ' 82' ' ' THR . . . 108.61 51.09 0.72 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.005 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 61.5 mtt-85 -130.43 97.85 4.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.909 0.385 . . . . 0.0 111.208 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.425 ' HA3' ' O ' ' A' ' 33' ' ' THR . . . 53.01 168.38 0.02 OUTLIER Glycine 0 C--N 1.331 0.255 0 CA-C-N 115.919 -0.582 . . . . 0.0 113.136 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.452 ' O ' ' HG ' ' A' ' 89' ' ' LEU . 1.0 OUTLIER -128.74 97.93 4.83 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.542 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.627 ' CB ' ' HB3' ' A' ' 34' ' ' PHE . . . -165.46 148.0 7.75 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.064 0.459 . . . . 0.0 111.659 178.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.662 ' CD1' ' N ' ' A' ' 91' ' ' TYR . 0.1 OUTLIER -92.5 136.96 32.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.906 -177.665 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.452 ' CG2' HG22 ' A' ' 72' ' ' ILE . 2.5 mp -89.52 109.62 20.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.318 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.544 ' N ' HG21 ' A' ' 72' ' ' ILE . 3.5 m-85 -88.41 117.49 27.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.86 0.362 . . . . 0.0 110.613 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -113.47 121.26 43.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.914 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' A' ' 70' ' ' LYS . 4.6 p-10 44.78 44.56 7.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.078 0.466 . . . . 0.0 110.838 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.44 ' N ' ' O ' ' A' ' 70' ' ' LYS . . . . . . . . 0 CA--C 1.52 0.365 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.931 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.118 0 CA-C-O 120.818 0.342 . . . . 0.0 111.014 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.437 HD22 ' CD2' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -84.06 151.08 25.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.72 -179.997 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 7.3 m80 -117.81 136.56 53.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.934 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -116.94 116.25 27.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.953 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.422 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 0.4 OUTLIER -155.14 145.48 15.95 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.159 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.401 ' CB ' HG12 ' A' ' 72' ' ' ILE . 73.7 Cg_endo -78.44 141.1 17.62 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.14 1.893 . . . . 0.0 112.526 -179.533 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -115.32 -165.42 1.03 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.031 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.03 -168.86 1.68 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.976 0.417 . . . . 0.0 111.276 -179.501 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.86 157.27 2.45 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.417 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.455 ' CG2' ' HB3' ' A' ' 25' ' ' LEU . 1.2 pp -112.03 -179.12 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.089 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.76 172.97 6.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.837 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.47 126.81 52.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.116 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.7 mm -141.41 158.17 21.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.214 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 12.9 p-10 -72.96 66.42 0.79 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.81 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 160.88 -130.55 2.39 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.361 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 -113.09 -15.26 12.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.696 0.284 . . . . 0.0 110.887 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 31.1 p -54.6 109.08 0.45 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.97 0.414 . . . . 0.0 111.424 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.405 ' HB ' ' CG2' ' A' ' 15' ' ' ILE . 35.3 m -122.73 118.89 56.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.619 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.86 106.49 16.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.492 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.455 ' HB3' ' CG2' ' A' ' 15' ' ' ILE . 0.3 OUTLIER -118.76 164.95 14.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.593 179.513 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 2.4 ttp -79.95 99.8 7.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.567 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.423 ' CD1' ' HB2' ' A' ' 28' ' ' LYS . 51.1 t80 -124.27 133.43 53.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.998 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.423 ' HB2' ' CD1' ' A' ' 27' ' ' TYR . 0.0 OUTLIER 57.37 28.68 15.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.93 179.988 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.54 4.91 85.48 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.941 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -136.78 143.9 44.61 Favored Pre-proline 0 C--N 1.332 -0.163 0 CA-C-N 116.737 0.269 . . . . 0.0 111.008 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.39 130.12 14.68 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.523 2.148 . . . . 0.0 112.28 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.42 ' HB2' ' CE2' ' A' ' 34' ' ' PHE . 8.3 mtt -139.67 134.24 31.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.004 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.54 129.3 35.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.834 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.42 ' CE2' ' HB2' ' A' ' 32' ' ' MET . 60.8 m-85 -138.73 158.23 44.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.972 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 -102.43 120.86 41.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.763 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -44.57 151.52 0.27 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.239 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.9 pp -59.52 138.24 57.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.029 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 27.4 mt . . . . . 0 C--N 1.328 -0.359 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.803 179.871 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.087 0 CA-C-O 120.902 0.382 . . . . 0.0 111.024 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.2 p -63.5 -28.61 70.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.956 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -55.13 -26.15 36.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.312 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -57.17 -31.53 65.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.076 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.476 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 44.6 p -87.11 -21.77 25.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.11 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.456 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 5.0 mtmt -89.18 -19.99 24.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.206 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.76 -64.26 1.17 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.779 -179.293 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 9.9 mmm -89.16 -52.97 4.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.8 -178.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . 0.476 ' HB3' ' O ' ' A' ' 62' ' ' THR . 83.5 t90 -62.11 -15.54 46.11 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.263 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.456 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 22.4 tt0 -89.57 -51.97 5.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.799 0.333 . . . . 0.0 111.15 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -80.02 -28.15 39.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.146 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -108.07 150.91 26.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.837 0.351 . . . . 0.0 111.186 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.8 mtpt -98.28 96.46 8.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.828 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.23 125.11 22.62 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.207 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.401 HG12 ' CB ' ' A' ' 11' ' ' PRO . 0.3 OUTLIER -88.01 154.1 3.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.264 179.263 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -134.28 151.36 51.23 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.422 ' HB ' ' O ' ' A' ' 10' ' ' GLU . 7.5 p -126.47 153.22 34.86 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.7 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.419 ' HG2' ' CD2' ' A' ' 34' ' ' PHE . 2.5 mp0 -100.98 166.86 10.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.904 0.383 . . . . 0.0 111.166 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.51 ' CG ' ' CZ ' ' A' ' 91' ' ' TYR . 6.3 m-30 -93.0 168.1 11.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.875 -179.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -96.89 91.91 5.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.715 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.85 -28.14 50.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.96 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 68.21 25.17 74.68 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.38 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.06 84.49 2.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.876 0.369 . . . . 0.0 110.587 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 61.0 ttt180 -50.95 100.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.07 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.4 p -58.79 120.9 9.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.596 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -115.31 -45.44 2.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.374 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.09 -50.33 11.11 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.198 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -133.0 -35.04 1.07 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.233 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 97.73 46.87 2.21 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.815 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 21.9 mtm180 -133.47 99.16 4.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.837 0.351 . . . . 0.0 111.307 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -85.07 -121.46 1.03 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.371 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.2 mt -128.18 128.19 44.32 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.843 0.354 . . . . 0.0 110.965 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.42 ' C ' ' CD1' ' A' ' 91' ' ' TYR . . . -111.56 148.67 32.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.263 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.51 ' CZ ' ' CG ' ' A' ' 76' ' ' PHE . 1.6 m-85 -137.07 158.28 44.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.339 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 2.0 pp -124.85 111.75 29.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.862 0.363 . . . . 0.0 111.623 -179.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -98.71 134.44 41.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.602 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.47 110.84 22.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.286 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.2 t0 47.82 30.47 1.91 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.168 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.396 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.352 -179.926 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.069 0 CA-C-O 120.845 0.355 . . . . 0.0 111.069 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.9 pp -73.1 157.0 38.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.958 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 5.2 m170 -80.07 124.81 29.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.711 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 ptpt -101.09 107.73 19.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.939 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -155.14 120.84 2.62 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.796 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -78.72 146.81 21.4 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.299 1.999 . . . . 0.0 112.124 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -127.83 -86.78 0.57 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.347 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.425 ' HA ' HG13 ' A' ' 72' ' ' ILE . 0.1 OUTLIER 167.57 119.77 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.678 0.275 . . . . 0.0 110.991 -179.908 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.9 tp -85.8 155.84 20.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.202 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.7 mt -125.2 -72.34 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -120.23 146.51 45.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.893 0.377 . . . . 0.0 111.289 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.405 ' HA ' ' CG1' ' A' ' 23' ' ' VAL . . . -127.1 97.94 5.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.941 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.7 pt -64.62 -164.23 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.108 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -69.14 63.4 0.13 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.644 0.259 . . . . 0.0 111.499 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 42.58 70.21 0.52 Allowed Glycine 0 CA--C 1.519 0.289 0 C-N-CA 121.23 -0.51 . . . . 0.0 113.295 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -147.09 -39.57 0.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.592 0.234 . . . . 0.0 111.128 179.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.7 t -169.5 120.74 0.7 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.867 0.365 . . . . 0.0 111.144 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.526 ' O ' ' HA ' ' A' ' 33' ' ' THR . 33.6 m -117.66 131.73 69.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.885 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.407 ' HB3' ' HB ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -79.13 147.35 32.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.924 0.392 . . . . 0.0 111.209 -179.572 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.1 tp -141.01 125.37 17.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.82 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 7.7 mtt -72.92 99.82 2.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.821 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -125.67 126.94 45.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.965 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.53 33.23 20.65 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.085 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.21 20.67 73.35 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.457 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -134.66 119.71 14.08 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.542 0.21 . . . . 0.0 110.84 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -59.72 133.52 51.77 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.401 2.067 . . . . 0.0 112.431 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.6 ' HB3' ' CE2' ' A' ' 34' ' ' PHE . 15.2 mmt -132.33 110.16 10.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.155 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.526 ' HA ' ' O ' ' A' ' 23' ' ' VAL . 8.8 t -120.69 86.3 2.55 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -179.125 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.6 ' CE2' ' HB3' ' A' ' 32' ' ' MET . 1.7 p90 -142.09 106.26 4.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.438 177.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 13.4 ttp180 -140.55 97.08 3.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.634 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.426 ' CD1' ' HA2' ' A' ' 88' ' ' GLY . 0.5 OUTLIER -142.54 88.78 2.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.894 0.378 . . . . 0.0 110.75 178.971 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -133.03 93.73 3.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.794 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.451 ' CD1' ' N ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.841 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.101 0 CA-C-O 120.836 0.35 . . . . 0.0 111.249 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.3 m -62.35 -30.8 71.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.089 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.62 -30.47 71.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.232 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 35.3 t80 -71.97 -42.07 66.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.041 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.41 ' CA ' ' HB3' ' A' ' 66' ' ' TRP . 81.1 p -76.11 -48.82 19.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.928 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.454 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -53.8 -21.33 7.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.442 -179.949 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.51 -60.86 1.85 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.301 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.426 ' O ' ' N ' ' A' ' 69' ' ' ALA . 18.9 mtm -90.12 -51.97 5.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.91 -179.145 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . 0.41 ' HB3' ' CA ' ' A' ' 62' ' ' THR . 64.3 t90 -59.99 -33.0 71.38 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -178.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.454 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -74.44 -50.19 19.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.741 0.305 . . . . 0.0 111.659 -179.365 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -79.8 -28.67 40.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.429 -179.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.426 ' N ' ' O ' ' A' ' 65' ' ' MET . . . -108.47 148.5 30.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.224 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.9 mmmm -104.25 92.81 4.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.444 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -140.4 98.81 3.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.974 -179.776 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.431 ' CD1' ' N ' ' A' ' 72' ' ' ILE . 0.0 OUTLIER -139.66 131.44 33.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.18 0.514 . . . . 0.0 111.767 179.883 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -165.18 178.97 6.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.014 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.7 t -100.9 136.36 32.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.756 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -130.84 -5.91 4.02 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -179.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.641 ' HB3' ' O ' ' A' ' 90' ' ' ALA . 2.7 p90 -92.14 137.86 32.01 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.129 0.49 . . . . 0.0 111.771 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -104.58 91.83 4.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.229 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.8 tptp -78.41 -71.93 0.4 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.193 -179.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 95.62 -27.74 14.77 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.244 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.9 -163.35 0.47 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.622 0.248 . . . . 0.0 110.568 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -119.1 18.27 13.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.474 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 16.4 p -109.07 120.04 41.34 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.909 0.385 . . . . 0.0 111.011 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.534 ' O ' ' HB3' ' A' ' 87' ' ' ARG . 4.7 m-20 -116.92 -52.15 2.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.316 0.579 . . . . 0.0 109.665 178.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 4.5 mtpt -111.19 -32.94 6.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.675 178.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 46.0 m-85 -87.69 46.48 1.38 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.884 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 130.44 44.04 0.18 Allowed Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.951 -0.642 . . . . 0.0 111.57 -179.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . 0.534 ' HB3' ' O ' ' A' ' 83' ' ' ASP . 0.0 OUTLIER -57.8 132.97 54.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.137 0.494 . . . . 0.0 110.229 179.394 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.426 ' HA2' ' CD1' ' A' ' 36' ' ' LEU . . . -129.92 -35.72 0.42 Allowed Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.703 -0.761 . . . . 0.0 113.538 -179.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.573 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER -103.46 148.47 25.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.819 0.342 . . . . 0.0 111.554 -179.14 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.641 ' O ' ' HB3' ' A' ' 76' ' ' PHE . . . -118.62 147.19 44.0 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.435 0.532 . . . . 0.0 112.435 -179.105 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -116.04 144.99 43.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.016 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 1.3 tt -150.11 113.57 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.84 179.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -108.07 123.44 48.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.069 0.462 . . . . 0.0 111.156 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -134.18 91.8 2.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.158 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 38.4 t70 50.39 58.07 5.9 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.484 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.764 179.769 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.457 -0.092 0 CA-C-O 120.891 0.377 . . . . 0.0 110.93 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.05 157.13 38.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.93 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -79.71 155.04 28.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.707 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.79 132.17 39.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.185 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -155.03 120.13 2.59 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.767 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -80.27 170.96 15.57 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.507 2.138 . . . . 0.0 112.685 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.479 ' O ' ' CB ' ' A' ' 13' ' ' THR . . . -136.57 -80.3 0.4 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.742 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.479 ' CB ' ' O ' ' A' ' 12' ' ' ALA . 3.8 m 90.43 -69.36 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.651 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.49 87.02 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.818 0.342 . . . . 0.0 111.272 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.47 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 2.6 pp -125.48 -179.1 2.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.114 0.483 . . . . 0.0 111.726 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.9 mtpt -133.31 173.01 11.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.26 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -93.87 130.27 39.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.873 0.368 . . . . 0.0 111.255 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.5 mp -140.34 157.98 25.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.974 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.03 146.52 25.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.975 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.18 -129.95 10.11 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.519 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -126.16 89.32 3.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.728 0.299 . . . . 0.0 110.858 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.8 t -174.15 136.4 0.5 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.048 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.7 m -142.32 117.98 5.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.128 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.501 ' HA ' ' O ' ' A' ' 32' ' ' MET . 1.4 tttp -79.68 97.68 6.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.444 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.431 ' HB3' ' CB ' ' A' ' 12' ' ' ALA . 0.4 OUTLIER -97.7 145.36 26.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.363 179.277 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 14.2 ttt -72.86 99.32 2.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.922 0.392 . . . . 0.0 110.718 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -105.11 94.93 5.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.855 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 65.1 tttt 53.99 29.95 10.94 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.982 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 82.47 22.01 59.25 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.585 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -124.67 122.37 25.72 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-O 120.484 0.183 . . . . 0.0 110.753 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.61 127.53 23.97 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.416 2.077 . . . . 0.0 112.394 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.501 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 1.4 ptm -139.55 110.11 6.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.586 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.84 94.37 4.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.891 0.377 . . . . 0.0 111.51 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.798 ' HB2' ' HB2' ' A' ' 90' ' ' ALA . 2.2 m-85 -141.14 143.34 34.21 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.11 0.481 . . . . 0.0 110.133 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.414 ' HA ' ' O ' ' A' ' 90' ' ' ALA . 6.3 ttt180 -143.63 98.12 3.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.013 -0.54 . . . . 0.0 112.063 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.481 ' HB2' ' CB ' ' A' ' 89' ' ' LEU . 0.2 OUTLIER -142.72 88.68 2.08 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.318 178.91 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 pp -125.89 84.04 2.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.783 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.843 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.369 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.546 ' O ' ' N ' ' A' ' 61' ' ' PHE . 89.4 p -100.59 -14.75 18.05 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 113.009 -1.905 . . . . 0.0 114.141 -178.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -37.0 -16.2 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -175.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.546 ' N ' ' O ' ' A' ' 59' ' ' SER . 5.6 t80 -52.63 -42.4 64.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 118.416 0.553 . . . . 0.0 111.379 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.418 ' HA ' ' HB2' ' A' ' 66' ' ' TRP . 32.9 p -82.38 -43.14 17.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.85 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.05 -20.12 15.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.507 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 44.8 mmtt -86.84 -63.73 1.26 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.768 0.318 . . . . 0.0 111.187 -179.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 2.8 ttp -89.27 -55.31 3.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.197 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . 0.45 ' CZ2' HG22 ' A' ' 72' ' ' ILE . 0.6 OUTLIER -51.4 -26.64 8.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.57 -179.738 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -94.06 -36.77 11.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.44 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -79.98 -28.15 39.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.347 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -108.3 150.97 26.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.094 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.31 92.96 9.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.009 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.435 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -160.35 98.86 1.29 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.923 179.936 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.45 HG22 ' CZ2' ' A' ' 66' ' ' TRP . 1.6 mp -136.05 130.96 49.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.963 0.411 . . . . 0.0 111.462 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -151.76 157.0 41.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.671 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -136.17 153.08 31.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.933 0.397 . . . . 0.0 111.194 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -163.55 78.66 0.42 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.701 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.439 ' CD2' ' O ' ' A' ' 89' ' ' LEU . 26.3 p90 -142.7 158.86 43.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.148 0.499 . . . . 0.0 111.523 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.23 162.76 4.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.411 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 67.3 mttt -50.55 -26.88 5.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.243 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.2 40.97 54.85 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.813 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -91.32 51.0 1.83 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.956 0.408 . . . . 0.0 110.799 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -122.68 -39.19 2.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.123 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.44 122.2 13.39 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.078 0.466 . . . . 0.0 111.047 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -115.46 -47.76 2.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.86 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.61 -61.06 2.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.113 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -80.97 -35.47 32.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.155 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.76 25.59 52.7 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.082 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . 0.472 ' O ' ' O ' ' A' ' 88' ' ' GLY . 4.3 mtp85 -131.97 107.07 8.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.849 0.356 . . . . 0.0 110.645 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.472 ' O ' ' O ' ' A' ' 87' ' ' ARG . . . -54.29 -150.71 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.228 0 CA-C-N 115.736 -0.665 . . . . 0.0 113.125 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.481 ' CB ' ' HB2' ' A' ' 36' ' ' LEU . 0.5 OUTLIER -128.32 132.92 48.62 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 122.778 -0.248 . . . . 0.0 111.377 -179.223 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.798 ' HB2' ' HB2' ' A' ' 34' ' ' PHE . . . -128.76 154.84 45.98 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 120.35 -0.54 . . . . 0.0 112.134 178.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.468 ' CD1' ' O ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -117.8 127.12 53.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.81 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 8.6 pt -79.9 130.85 35.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.129 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -117.58 117.93 30.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.836 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.41 104.58 16.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.051 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.402 ' N ' ' HB2' ' A' ' 71' ' ' LYS . 0.4 OUTLIER 64.63 36.31 8.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.946 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 0.222 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.625 179.92 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.457 -0.093 0 CA-C-O 120.712 0.291 . . . . 0.0 110.74 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.5 mt -120.02 113.78 21.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.313 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 40.2 m-70 -71.59 99.9 2.17 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.38 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.7 mmtp -118.3 158.82 24.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.355 -179.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -104.22 164.68 14.81 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.232 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.451 ' HA ' ' CG ' ' A' ' 73' ' ' GLU . 86.6 Cg_endo -78.03 106.11 2.11 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.31 2.006 . . . . 0.0 112.857 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.578 ' O ' ' OG1' ' A' ' 13' ' ' THR . . . -158.19 124.5 4.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.389 179.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.692 ' HA ' ' HB3' ' A' ' 25' ' ' LEU . 76.1 m -176.31 24.88 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.888 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -98.09 83.81 3.17 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.013 -0.675 . . . . 0.0 110.06 178.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.423 ' HB ' ' CG ' ' A' ' 24' ' ' LYS . 2.1 mm -127.63 -70.88 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.395 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt -145.61 140.98 27.76 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.933 179.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.86 133.84 39.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.966 0.413 . . . . 0.0 111.622 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.468 HD13 HG23 ' A' ' 18' ' ' ILE . 16.5 mt -153.16 159.31 3.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.781 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.76 172.25 5.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.864 0.364 . . . . 0.0 111.042 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.448 ' CA ' ' HB2' ' A' ' 36' ' ' LEU . . . -69.73 65.85 0.63 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.835 -0.697 . . . . 0.0 112.472 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -148.18 -52.16 0.18 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.041 0.448 . . . . 0.0 110.143 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -143.19 106.48 4.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.818 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 23.2 t -130.78 128.09 62.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.324 179.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.423 ' CG ' ' HB ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -92.59 144.35 25.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.183 0.516 . . . . 0.0 111.944 -179.093 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.692 ' HB3' ' HA ' ' A' ' 13' ' ' THR . 0.0 OUTLIER -132.28 165.33 24.42 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.986 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 6.7 mtt -77.18 98.62 5.15 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -128.17 113.94 16.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.074 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 52.01 26.25 3.63 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.95 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.31 13.82 76.92 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.779 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -124.86 140.88 36.73 Favored Pre-proline 0 C--N 1.332 -0.16 0 CA-C-O 120.666 0.27 . . . . 0.0 111.024 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -68.16 135.78 35.56 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.481 2.12 . . . . 0.0 111.973 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.431 ' O ' HD11 ' A' ' 25' ' ' LEU . 2.5 mmt -145.11 110.46 5.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.244 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 61.9 p -77.02 131.04 38.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.16 0.505 . . . . 0.0 112.277 -179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.526 ' CD1' ' HB2' ' A' ' 89' ' ' LEU . 2.3 m-30 -106.57 158.73 16.71 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.976 179.461 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -115.64 148.08 40.07 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.348 179.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.526 ' HA ' ' HB3' ' A' ' 91' ' ' TYR . 0.1 OUTLIER -104.45 134.64 47.3 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.088 0.47 . . . . 0.0 111.682 -179.364 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.8 tp -144.25 133.74 23.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.618 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.281 0 CA-C-O 120.812 0.339 . . . . 0.0 111.053 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.044 0 CA-C-O 120.876 0.369 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.35 -38.54 89.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.832 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.51 -32.07 73.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.016 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.34 -51.78 68.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.641 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 51.4 p -58.2 -45.54 87.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.783 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.9 tttm -54.92 -19.83 7.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.34 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.19 -63.38 1.31 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.935 0.398 . . . . 0.0 111.204 -179.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.5 ' O ' ' N ' ' A' ' 69' ' ' ALA . 2.1 mtt -87.93 -58.87 2.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.223 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 74.9 t90 -51.55 -32.0 26.54 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -94.44 -52.66 4.23 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -179.168 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -79.47 -28.29 41.54 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.746 0.308 . . . . 0.0 111.625 -178.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 65' ' ' MET . . . -107.69 151.21 25.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.597 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.2 mtmt -103.41 97.25 7.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.844 0.354 . . . . 0.0 111.94 -178.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.443 ' HD3' ' CB ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -166.25 96.63 0.59 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.712 178.79 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.415 ' CB ' ' HB ' ' A' ' 13' ' ' THR . 1.3 mp -141.47 103.83 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.148 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.451 ' CG ' ' HA ' ' A' ' 11' ' ' PRO . 16.1 mt-10 -136.84 151.43 49.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.845 0.355 . . . . 0.0 111.796 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.471 HG12 ' CE2' ' A' ' 34' ' ' PHE . 2.0 m -103.81 153.63 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.793 -179.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.56 -75.41 0.61 Allowed 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.989 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -143.39 146.33 33.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.852 0.358 . . . . 0.0 111.007 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -59.12 148.29 31.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.093 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.404 ' NZ ' ' HB2' ' A' ' 80' ' ' GLN . 0.2 OUTLIER -101.2 -61.35 1.38 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.835 179.872 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 100.89 41.17 2.71 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.884 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.404 ' HB2' ' NZ ' ' A' ' 78' ' ' LYS . 2.8 mt-30 -123.97 150.77 44.41 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.855 0.36 . . . . 0.0 110.922 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 69.1 9.97 7.64 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.24 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.515 ' HB ' ' O ' ' A' ' 85' ' ' TYR . 0.5 OUTLIER -109.3 148.42 31.06 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.658 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -84.69 -52.57 5.98 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.073 0.463 . . . . 0.0 110.079 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.9 mttt -110.51 -57.29 2.24 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 177.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.737 ' O ' ' N ' ' A' ' 87' ' ' ARG . 65.9 m-85 -133.35 -37.7 0.95 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 113.879 -1.51 . . . . 0.0 107.985 176.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . 0.419 ' CA ' ' HB ' ' A' ' 82' ' ' THR . . . 44.28 -36.71 0.0 OUTLIER Glycine 0 N--CA 1.472 1.086 0 C-N-CA 125.188 1.375 . . . . 0.0 115.662 177.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . 0.737 ' N ' ' O ' ' A' ' 85' ' ' TYR . 0.1 OUTLIER -142.69 95.88 2.85 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 176.912 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -77.42 13.03 12.04 Favored Glycine 0 C--N 1.313 -0.75 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.179 179.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.526 ' HB2' ' CD1' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -128.2 149.81 50.29 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 122.787 0.435 . . . . 0.0 110.229 -179.17 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.449 ' O ' ' CD2' ' A' ' 34' ' ' PHE . . . -101.49 -178.31 3.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.023 0.44 . . . . 0.0 111.861 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.526 ' HB3' ' HA ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -71.97 145.69 48.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.834 -178.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.416 HG23 HG13 ' A' ' 74' ' ' VAL . 1.3 pp -96.55 160.31 2.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.99 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -110.91 119.13 38.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.013 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -97.44 93.74 6.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.082 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 12.3 t0 67.05 52.46 0.87 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.873 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.405 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.598 179.85 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.7 mtpt . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.882 0.372 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.07 153.98 22.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.827 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -93.48 147.24 23.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.864 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.27 122.76 21.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.103 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -146.11 131.64 9.28 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.514 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.471 ' HA ' ' HA ' ' A' ' 73' ' ' GLU . 84.8 Cg_endo -79.75 171.13 16.0 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.293 1.995 . . . . 0.0 112.732 -179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -153.65 -136.18 0.06 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.717 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 3.5 t -162.24 178.44 8.73 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.743 0.306 . . . . 0.0 110.799 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.417 ' HB3' ' CZ2' ' A' ' 66' ' ' TRP . 0.0 OUTLIER -97.16 94.82 7.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.988 0.423 . . . . 0.0 111.076 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.9 mt -85.84 -68.63 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.007 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.4 ttpp -110.05 169.74 8.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.472 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -87.12 148.31 25.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.049 0.452 . . . . 0.0 111.85 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.414 ' CD1' ' HB ' ' A' ' 23' ' ' VAL . 5.9 tp -111.35 119.04 58.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.156 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -118.24 28.93 8.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.835 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.38 38.17 29.65 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.345 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -147.12 -49.47 0.19 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.747 0.308 . . . . 0.0 110.834 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 71.8 p -157.97 139.58 13.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.17 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.424 HG12 ' CD2' ' A' ' 91' ' ' TYR . 12.5 p -142.43 114.05 3.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.693 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.4 ptpt -91.02 125.98 35.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.386 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 21.6 mt -124.49 157.0 36.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.606 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.99 99.89 2.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.905 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -124.37 108.47 12.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.705 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 62.7 23.75 14.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.036 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 89.96 -14.14 62.73 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.92 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -110.66 144.82 31.03 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.838 0.319 . . . . 0.0 111.089 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -73.6 151.65 47.27 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.513 2.142 . . . . 0.0 112.199 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.445 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 1.7 mmm -145.15 113.77 6.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.093 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 37.2 p -89.81 86.68 6.72 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.411 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.445 ' CD1' ' HB3' ' A' ' 32' ' ' MET . 1.9 p90 -141.31 118.76 11.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.071 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.409 ' O ' ' HG2' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -139.89 120.27 13.98 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.347 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.522 ' HB3' ' HA ' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -143.11 146.51 33.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.12 178.201 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -144.17 135.08 25.21 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.935 0.398 . . . . 0.0 111.27 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.7 tt . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.772 179.9 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.813 0.339 . . . . 0.0 110.966 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.6 p -62.07 -19.11 62.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.123 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -51.3 -29.06 13.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.771 0.32 . . . . 0.0 111.418 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -60.18 -63.87 1.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.809 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.426 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 0.6 OUTLIER -66.92 -34.79 78.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.749 -179.978 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 13.2 mttm -51.15 -19.85 1.31 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.627 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -81.02 -61.85 1.84 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.83 0.347 . . . . 0.0 111.013 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.443 ' O ' ' N ' ' A' ' 69' ' ' ALA . 5.7 mmt -88.68 -52.56 5.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.964 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . 0.426 ' HB3' ' O ' ' A' ' 62' ' ' THR . 68.2 t90 -53.66 -27.37 27.07 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.69 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -94.51 -56.42 2.81 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -79.88 -28.4 39.91 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 65' ' ' MET . . . -104.59 144.08 32.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.826 0.346 . . . . 0.0 110.866 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -96.59 92.6 6.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.153 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.453 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -162.06 98.11 1.05 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.015 179.536 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 2.7 mp -139.54 133.09 37.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.166 0.507 . . . . 0.0 111.96 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.576 ' HB2' ' CG ' ' A' ' 93' ' ' TYR . 10.3 mt-10 -146.7 170.09 17.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.353 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 27.2 m -108.14 131.99 57.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.977 0.417 . . . . 0.0 111.546 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -91.49 -164.33 1.16 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.845 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.3 p90 -92.89 136.39 33.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.056 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 36.6 p30 -103.94 162.0 13.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.044 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.0 ttmt -58.92 -66.45 0.5 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.946 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 91.23 27.72 17.35 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.588 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -129.0 -54.35 1.21 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.836 0.35 . . . . 0.0 110.984 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.87 97.9 9.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.83 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.52 ' HB ' ' HA2' ' A' ' 86' ' ' GLY . 1.6 p -83.49 171.04 13.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.726 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -115.23 -51.79 2.7 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 44.3 tttm -110.83 -64.34 1.29 Allowed 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -179.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -133.77 2.45 3.43 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . 0.52 ' HA2' ' HB ' ' A' ' 82' ' ' THR . . . 128.15 51.01 0.14 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.307 -0.949 . . . . 0.0 112.601 -179.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 4.2 mtp85 -104.51 98.76 8.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.707 0.289 . . . . 0.0 110.991 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.442 ' O ' ' HB2' ' A' ' 34' ' ' PHE . . . -54.16 108.91 0.97 Allowed Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 178.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.21 96.47 4.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.423 0.63 . . . . 0.0 112.63 -177.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.522 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . . . -174.78 113.66 0.15 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.145 177.299 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.513 ' O ' ' CG ' ' A' ' 91' ' ' TYR . 0.0 OUTLIER -145.67 102.93 3.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.527 179.993 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 32.1 mm -150.04 107.7 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.181 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.576 ' CG ' ' HB2' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -153.24 135.43 14.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.036 178.848 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -134.42 99.75 4.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.875 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.441 ' CA ' ' HB2' ' A' ' 71' ' ' LYS . 4.4 t0 57.89 41.55 24.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.822 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.493 -179.994 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.762 0.315 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.99 157.09 35.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.902 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -89.12 142.06 27.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.765 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.4 mmmt -83.62 107.97 16.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.017 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -140.33 133.74 15.08 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.698 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -79.55 112.58 2.98 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.435 2.09 . . . . 0.0 112.636 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -166.07 104.6 0.66 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.026 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.641 ' HA ' ' HB3' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -174.14 9.0 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.253 -0.43 . . . . 0.0 112.063 179.816 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.416 HD12 ' CH2' ' A' ' 66' ' ' TRP . 11.7 tp -98.67 85.08 3.26 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 120.691 -0.403 . . . . 0.0 111.346 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.44 HD13 HG22 ' A' ' 15' ' ' ILE . 32.5 mt -126.8 -68.43 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.91 178.348 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.9 tptt -130.99 122.76 27.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.297 178.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.459 ' CB ' ' CZ3' ' A' ' 66' ' ' TRP . . . -76.91 120.86 22.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.086 0.47 . . . . 0.0 112.028 -178.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 25.0 mm -147.51 158.59 8.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.221 179.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.82 -176.16 0.63 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.534 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -66.84 70.22 0.18 Allowed Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.079 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -147.71 -51.98 0.19 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.912 0.386 . . . . 0.0 110.623 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.444 ' HA ' ' O ' ' A' ' 34' ' ' PHE . 1.5 t -154.55 106.38 2.72 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.578 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.446 ' CG2' ' HB2' ' A' ' 34' ' ' PHE . 2.6 m -132.67 113.92 21.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.898 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.94 138.75 37.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.13 0.491 . . . . 0.0 112.011 -178.575 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.641 ' HB3' ' HA ' ' A' ' 13' ' ' THR . 0.1 OUTLIER -121.6 127.33 50.77 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.035 179.409 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -72.83 99.59 2.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.93 0.395 . . . . 0.0 110.886 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -117.38 114.4 23.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.806 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 59.91 28.15 17.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.812 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 82.66 18.98 64.67 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.72 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.34 128.07 21.03 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.656 0.228 . . . . 0.0 110.952 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -74.14 126.93 10.87 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.444 2.096 . . . . 0.0 112.227 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 18.5 mmt -119.17 110.73 17.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.167 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.3 m -70.98 157.13 38.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.334 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.482 ' CG ' ' CB ' ' A' ' 90' ' ' ALA . 1.9 m-85 -120.33 158.97 25.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.581 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -116.57 148.31 41.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.979 0.418 . . . . 0.0 111.082 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.2 tt -48.71 119.46 3.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.487 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.464 ' O ' ' O ' ' A' ' 38' ' ' LEU . 1.9 pp -49.06 165.23 0.06 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.912 179.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.464 ' O ' ' O ' ' A' ' 37' ' ' LEU . 23.0 tp . . . . . 0 N--CA 1.47 0.525 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -179.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.835 0.35 . . . . 0.0 111.38 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -88.87 -24.1 22.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.042 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -76.16 -28.85 57.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.253 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -56.88 -48.01 79.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.939 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.434 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 1.3 t -64.63 -15.48 61.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.383 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.5 tttp -89.14 -66.47 0.92 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.414 ' O ' ' N ' ' A' ' 68' ' ' ASN . 8.8 mttt -88.79 -64.34 1.16 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.978 0.418 . . . . 0.0 111.998 -178.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.91 -21.53 3.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.745 -179.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . 0.459 ' CZ3' ' CB ' ' A' ' 17' ' ' ALA . 22.9 t90 -99.2 -37.34 9.33 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -179.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -94.11 -49.02 5.95 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -178.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.414 ' N ' ' O ' ' A' ' 64' ' ' LYS . 91.3 m-20 -79.72 -28.37 40.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.663 0.268 . . . . 0.0 111.565 -179.171 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -108.15 151.05 26.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.747 0.308 . . . . 0.0 111.092 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.2 mmtt -96.35 96.01 8.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.27 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.699 ' HB2' ' N ' ' A' ' 95' ' ' ASP . 0.0 OUTLIER -166.14 100.52 0.63 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.648 179.577 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.51 HG22 HD13 ' A' ' 72' ' ' ILE . 0.0 OUTLIER -139.23 105.27 2.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.471 -179.659 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -128.73 169.7 14.19 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.249 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.1 t -115.18 147.4 18.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.852 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.425 ' HB2' ' CE2' ' A' ' 93' ' ' TYR . 4.8 tt0 -110.78 -69.95 0.84 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.696 0.284 . . . . 0.0 111.613 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -110.04 118.16 35.67 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.896 0.379 . . . . 0.0 111.371 -179.318 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -104.2 91.83 4.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.464 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -61.18 -83.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.043 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 91.86 -29.0 7.79 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.712 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -110.69 -38.35 5.18 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.785 0.326 . . . . 0.0 110.893 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.4 ttt-85 -75.99 63.39 1.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.81 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.402 ' CG2' ' HA2' ' A' ' 86' ' ' GLY . 10.4 p -87.7 151.09 23.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.712 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -114.97 -51.9 2.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.25 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.79 -64.03 1.32 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.866 0.365 . . . . 0.0 111.286 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -133.79 12.39 4.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.447 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . 0.402 ' HA2' ' CG2' ' A' ' 82' ' ' THR . . . 128.08 0.75 6.41 Favored Glycine 0 CA--C 1.519 0.342 0 C-N-CA 120.518 -0.849 . . . . 0.0 112.963 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -107.77 98.98 8.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.953 0.406 . . . . 0.0 110.978 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -117.32 -85.47 1.11 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.274 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.2 tp -102.28 101.01 11.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.721 0.296 . . . . 0.0 110.676 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.482 ' CB ' ' CG ' ' A' ' 34' ' ' PHE . . . -152.24 137.75 17.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.923 0.392 . . . . 0.0 111.506 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -142.15 122.23 13.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.635 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.423 HG22 ' CD2' ' A' ' 34' ' ' PHE . 2.7 pt -89.49 149.9 3.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.832 0.349 . . . . 0.0 111.275 -179.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.486 ' CD1' ' HA2' ' A' ' 96' ' ' GLY . 0.0 OUTLIER -137.77 168.09 20.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.081 179.466 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -94.08 99.73 11.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.715 -179.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.699 ' N ' ' HB2' ' A' ' 71' ' ' LYS . 1.9 t0 76.6 21.0 1.34 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.125 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.486 ' HA2' ' CD1' ' A' ' 93' ' ' TYR . . . . . . . . 0 CA--C 1.517 0.184 0 C-N-CA 121.035 -0.602 . . . . 0.0 112.912 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.2 mtpt . . . . . 0 N--CA 1.458 -0.043 0 CA-C-O 120.92 0.39 . . . . 0.0 110.897 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.96 151.19 22.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.942 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -120.56 88.92 3.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.675 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.72 158.18 29.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.01 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -104.76 158.6 31.67 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.714 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -78.87 157.31 27.42 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.426 2.084 . . . . 0.0 112.535 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -120.29 -90.25 0.58 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.318 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 175.67 164.24 0.33 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.89 0.376 . . . . 0.0 110.875 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.452 ' CB ' ' CZ2' ' A' ' 66' ' ' TRP . 1.7 pp -90.12 139.88 30.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.827 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.4 HD11 HG21 ' A' ' 15' ' ' ILE . 3.4 mt -125.08 -77.1 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.392 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.9 mtpt -145.2 137.99 26.21 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.88 0.372 . . . . 0.0 110.961 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -126.35 106.3 9.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.984 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -51.28 -77.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.311 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -118.16 -80.97 0.62 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.739 0.304 . . . . 0.0 110.841 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -174.71 33.5 0.1 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.528 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -122.08 -35.53 3.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.69 0.281 . . . . 0.0 111.039 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 t -147.03 139.58 24.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.808 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 29.4 t -142.79 129.58 18.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.277 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.421 ' HA ' ' O ' ' A' ' 32' ' ' MET . 0.0 OUTLIER -79.65 143.68 34.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.203 -179.76 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.428 HD23 ' CZ ' ' A' ' 91' ' ' TYR . 0.4 OUTLIER -136.52 165.01 26.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.645 179.797 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 23.3 mmt -84.98 99.85 11.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.858 0.361 . . . . 0.0 110.87 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -115.63 95.7 5.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.868 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.6 mmtm 58.32 30.18 19.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.956 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 91.33 -14.07 64.73 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.629 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -99.31 141.42 22.81 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 120.694 0.283 . . . . 0.0 110.871 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.54 134.71 15.59 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.514 2.142 . . . . 0.0 112.249 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.459 ' HB3' ' CE1' ' A' ' 34' ' ' PHE . 3.5 mmt -129.19 110.54 12.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.926 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.72 86.75 4.15 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.918 -179.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.498 ' CD1' ' N ' ' A' ' 34' ' ' PHE . 0.5 OUTLIER -137.78 107.11 6.1 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.779 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 tpt180 -140.38 127.72 21.22 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.458 ' CB ' ' HA ' ' A' ' 90' ' ' ALA . 6.9 tp -143.12 111.06 5.99 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.349 178.354 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -143.99 149.69 37.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.076 0.465 . . . . 0.0 111.603 -179.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.36 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.879 0.371 . . . . 0.0 111.102 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.7 t -60.08 -31.36 69.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.884 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -85.81 -29.98 23.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.199 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -60.25 -47.18 87.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.915 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 14.8 p -58.09 -50.08 74.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.82 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -21.63 9.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.107 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.3 tttm -88.44 -59.37 2.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.833 0.349 . . . . 0.0 110.961 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.427 ' O ' ' N ' ' A' ' 69' ' ' ALA . 5.8 mtt -90.27 -56.35 3.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.489 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . 0.452 ' CZ2' ' CB ' ' A' ' 14' ' ' LEU . 28.4 t90 -53.94 -24.75 17.49 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.71 0.263 . . . . 0.0 111.71 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.32 -48.32 6.21 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.567 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.93 -28.2 39.75 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.427 ' N ' ' O ' ' A' ' 65' ' ' MET . . . -105.02 151.23 24.21 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.785 0.326 . . . . 0.0 110.814 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.1 mmtt -95.37 92.95 6.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.878 -179.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.568 ' HB2' ' O ' ' A' ' 93' ' ' TYR . 0.0 OUTLIER -142.77 96.97 3.02 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.845 178.692 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -141.58 103.07 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.076 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.551 ' CB ' ' HB2' ' A' ' 93' ' ' TYR . 0.0 OUTLIER -166.81 178.65 5.75 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.664 -0.414 . . . . 0.0 111.263 177.862 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.425 ' HB ' ' CE1' ' A' ' 91' ' ' TYR . 11.7 p -123.45 153.02 28.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.889 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -99.52 -118.38 0.15 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.588 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 54.8 p90 -107.07 134.15 50.63 Favored 'General case' 0 N--CA 1.457 -0.085 0 CA-C-O 120.798 0.332 . . . . 0.0 111.039 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.7 p-10 -78.7 117.95 20.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.942 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.25 -34.0 19.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.996 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 57.64 28.78 60.37 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.492 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -91.97 -64.05 1.16 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.718 0.294 . . . . 0.0 110.9 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -54.81 42.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.826 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 11.9 t -70.72 120.86 16.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.622 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -115.38 -51.27 2.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.971 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.7 pttm -101.41 -29.34 12.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.898 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.14 -35.65 76.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.54 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 67.7 24.19 74.04 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.684 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . 0.426 ' HA ' ' CE2' ' A' ' 34' ' ' PHE . 0.6 OUTLIER -121.32 97.95 5.75 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.26 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -61.71 115.88 8.57 Favored Glycine 0 N--CA 1.452 -0.296 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 178.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.404 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.5 mt -77.25 97.3 4.79 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.151 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.458 ' HA ' ' CB ' ' A' ' 36' ' ' LEU . . . -174.17 114.24 0.19 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.116 177.722 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.485 ' CD1' ' HB2' ' A' ' 34' ' ' PHE . 0.3 OUTLIER -145.21 94.35 2.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.476 179.156 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 6.6 pt -150.17 108.86 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 C-N-CA 120.409 -0.516 . . . . 0.0 111.953 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.568 ' O ' ' HB2' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -151.65 168.78 23.91 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.387 179.294 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -122.07 106.48 11.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.833 0.349 . . . . 0.0 111.233 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.4 t0 52.07 26.21 3.66 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.835 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.268 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.57 -179.746 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.7 mttt . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.84 0.352 . . . . 0.0 110.858 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.7 pp -69.96 156.9 38.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.146 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 12.9 t60 -90.49 159.1 16.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.704 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.52 120.41 42.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.915 0.388 . . . . 0.0 111.356 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -137.83 129.02 15.98 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.336 179.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.724 ' HA ' ' HA ' ' A' ' 73' ' ' GLU . 87.7 Cg_endo -82.76 158.84 16.24 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.42 2.08 . . . . 0.0 112.939 -179.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -115.84 -129.87 0.3 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.56 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 175.99 -86.74 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.218 0 O-C-N 122.269 -0.27 . . . . 0.0 111.698 179.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.37 112.39 23.97 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.852 0.358 . . . . 0.0 111.234 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.47 ' CD1' HG12 ' A' ' 72' ' ' ILE . 2.6 mp -125.47 160.21 31.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.241 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.19 122.8 47.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.374 179.439 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.29 123.61 50.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.447 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.458 ' CG1' ' N ' ' A' ' 19' ' ' ASP . 0.5 OUTLIER -117.87 -89.43 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.812 179.755 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.458 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 1.0 OUTLIER -118.32 28.84 8.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.716 0.294 . . . . 0.0 110.977 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 61.32 57.42 18.34 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.233 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -147.19 -44.26 0.17 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.805 0.336 . . . . 0.0 110.795 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 54.6 p -132.51 106.87 8.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.182 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.413 HG21 ' CE1' ' A' ' 34' ' ' PHE . 27.5 m -128.76 113.71 30.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.52 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.6 ptmt -90.35 105.54 17.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.681 -179.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.432 HD21 ' CE2' ' A' ' 91' ' ' TYR . 1.7 pt? -108.1 165.05 11.77 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.347 179.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 2.7 ttm -77.37 99.85 5.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.857 0.361 . . . . 0.0 111.047 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -115.0 100.33 8.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.744 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 61.16 31.04 19.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.896 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.39 24.28 66.04 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.549 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -142.1 120.89 7.74 Favored Pre-proline 0 C--N 1.33 -0.257 0 O-C-N 122.769 -0.254 . . . . 0.0 110.981 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -59.72 132.41 45.3 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.353 2.035 . . . . 0.0 112.002 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 11.7 mtp -134.49 118.06 16.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.978 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -95.59 127.21 41.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.102 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.413 ' CE1' HG21 ' A' ' 23' ' ' VAL . 35.2 p90 -141.03 158.18 44.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.985 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -92.74 148.14 22.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.774 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.7 pp -48.98 153.95 0.81 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.297 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.96 155.05 39.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.093 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.818 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.088 0 CA-C-O 120.735 0.303 . . . . 0.0 111.412 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 94.8 p -92.93 -16.04 25.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.538 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -83.84 -61.76 1.74 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.716 0.293 . . . . 0.0 111.451 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -54.78 -53.87 49.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.259 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.518 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 36.9 p -59.7 -21.05 60.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.233 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.5 tttt -89.11 -19.48 25.49 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.334 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp -88.59 -64.18 1.18 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.857 -179.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -89.14 -54.31 4.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.685 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . 0.518 ' HB3' ' O ' ' A' ' 62' ' ' THR . 37.8 t90 -58.75 -18.55 32.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.713 -179.281 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.81 -44.6 9.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.826 0.346 . . . . 0.0 111.192 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -79.99 -28.04 39.56 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.184 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.407 ' CB ' ' HE3' ' A' ' 71' ' ' LYS . . . -108.04 151.21 26.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.86 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.2 ptpt -100.83 92.6 5.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.407 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.407 ' HE3' ' CB ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -138.26 98.03 3.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.052 179.423 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.47 HG12 ' CD1' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -139.86 119.88 13.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.771 0.319 . . . . 0.0 111.596 -179.545 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.724 ' HA ' ' HA ' ' A' ' 11' ' ' PRO . 10.4 mt-10 -149.25 172.11 15.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.479 179.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.426 ' HA ' ' HB2' ' A' ' 91' ' ' TYR . 34.9 t -100.85 141.57 17.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.4 -179.296 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -135.14 -2.86 2.5 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.464 ' CD1' ' HB3' ' A' ' 91' ' ' TYR . 0.0 OUTLIER -92.68 164.32 13.43 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.884 0.373 . . . . 0.0 111.573 -179.634 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -100.85 139.19 36.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.911 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.0 pttp -68.77 108.44 3.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.954 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 88.08 41.11 6.35 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.481 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.12 -63.69 1.36 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.785 0.326 . . . . 0.0 110.816 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -162.12 94.82 0.93 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.007 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.444 ' HB ' ' HA2' ' A' ' 86' ' ' GLY . 7.6 p -74.37 154.31 38.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.769 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -115.23 -51.8 2.7 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.293 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.6 tptt -110.74 -64.0 1.33 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.788 0.328 . . . . 0.0 111.612 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.415 ' O ' ' CG ' ' A' ' 85' ' ' TYR . 81.9 t80 -133.9 11.15 3.96 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.623 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . 0.444 ' HA2' ' HB ' ' A' ' 82' ' ' THR . . . 128.09 -15.33 6.18 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.573 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -90.3 98.76 11.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.781 0.324 . . . . 0.0 110.929 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -147.11 -44.54 0.03 OUTLIER Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.438 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -81.5 148.36 29.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.897 0.38 . . . . 0.0 110.904 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.416 ' O ' ' HB3' ' A' ' 76' ' ' PHE . . . -102.67 142.56 33.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.206 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.464 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . 1.8 p90 -141.04 88.01 2.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.012 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -150.2 141.2 16.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.081 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.442 ' CD1' ' HG3' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -123.36 117.99 26.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.619 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -111.43 91.87 3.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.051 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 58.2 23.81 10.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.065 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.356 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.551 -179.974 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 tppm? . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.813 0.34 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.416 ' CD1' ' HG2' ' A' ' 9' ' ' LYS . 0.7 OUTLIER -96.2 146.62 24.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.92 -179.883 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -114.03 109.77 18.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.912 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.416 ' HG2' ' CD1' ' A' ' 7' ' ' LEU . 1.0 OUTLIER -122.04 159.09 27.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.154 -179.852 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -104.09 164.27 15.66 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.627 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.427 ' CA ' ' HG3' ' A' ' 73' ' ' GLU . 91.0 Cg_endo -78.48 150.07 24.7 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.596 2.197 . . . . 0.0 112.692 -179.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -121.34 -81.86 0.64 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.194 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 171.36 131.25 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.725 0.298 . . . . 0.0 111.001 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -98.19 130.29 44.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.994 179.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.451 HG13 ' H ' ' A' ' 16' ' ' LYS . 0.8 OUTLIER -84.46 -51.52 13.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.231 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.451 ' H ' HG13 ' A' ' 15' ' ' ILE . 14.2 tttm -164.46 151.26 11.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.518 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -125.43 148.05 48.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.406 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.457 HD13 HG21 ' A' ' 18' ' ' ILE . 31.9 pt -123.82 -167.0 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.914 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -71.19 62.7 0.33 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.796 0.332 . . . . 0.0 111.431 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.41 ' HA3' ' CD2' ' A' ' 36' ' ' LEU . . . 44.33 77.22 0.1 OUTLIER Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.989 -0.625 . . . . 0.0 113.095 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -147.64 -46.26 0.17 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.98 0.419 . . . . 0.0 110.796 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -167.99 106.93 0.52 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.873 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 32.6 m -121.35 113.85 41.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.672 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.66 147.4 25.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.358 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.419 HD21 ' CD2' ' A' ' 34' ' ' PHE . 0.1 OUTLIER -137.99 137.21 37.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.176 179.622 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 3.1 tpt -72.75 99.43 2.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.923 0.392 . . . . 0.0 110.863 -179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -118.78 116.22 26.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.702 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 25.4 mmtm 58.86 28.09 17.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.89 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.12 25.5 66.28 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.553 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -142.07 113.07 6.28 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 120.453 0.168 . . . . 0.0 110.901 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.83 141.0 95.9 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.477 2.118 . . . . 0.0 112.271 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.426 ' HB3' ' CZ ' ' A' ' 34' ' ' PHE . 0.6 OUTLIER -142.2 110.92 6.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.979 -179.848 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.422 ' O ' ' CD1' ' A' ' 34' ' ' PHE . 1.4 t -78.28 139.9 38.86 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.196 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.52 ' CD1' ' CD2' ' A' ' 91' ' ' TYR . 26.0 m-85 -141.39 138.51 33.04 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.194 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -101.11 148.07 25.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.641 179.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.41 ' CD2' ' HA3' ' A' ' 20' ' ' GLY . 0.3 OUTLIER -56.57 169.3 0.48 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.34 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -95.73 163.06 13.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.932 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.772 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.805 0.336 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 t -71.59 -24.12 61.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.063 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -55.5 -23.24 24.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.371 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -53.38 -52.06 60.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.085 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.405 ' O ' ' N ' ' A' ' 66' ' ' TRP . 1.3 p -60.98 -47.86 84.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.966 0.412 . . . . 0.0 110.914 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.2 mtmt -55.7 -20.03 12.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.358 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.4 tptt -84.98 -59.8 2.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.722 0.296 . . . . 0.0 111.37 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 14.0 mtt -90.01 -49.9 6.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.313 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . 0.439 ' CE2' HG21 ' A' ' 72' ' ' ILE . 10.0 t-105 -54.79 -34.72 63.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.303 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -94.49 -52.13 4.46 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -79.79 -28.38 40.3 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.353 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.42 ' CB ' ' HD3' ' A' ' 71' ' ' LYS . . . -107.22 151.16 25.8 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.839 0.352 . . . . 0.0 111.224 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.4 tttt -89.69 92.99 9.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.568 -179.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.493 ' HB2' ' CA ' ' A' ' 94' ' ' ALA . 0.0 OUTLIER -166.22 98.33 0.61 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.556 179.096 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.439 HG21 ' CE2' ' A' ' 66' ' ' TRP . 4.8 pt -139.9 128.79 27.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.0 0.428 . . . . 0.0 111.828 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.427 ' HG3' ' CA ' ' A' ' 11' ' ' PRO . 0.2 OUTLIER -162.42 171.02 17.81 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.032 179.605 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.428 HG11 ' CD1' ' A' ' 91' ' ' TYR . 0.4 OUTLIER -111.28 152.99 13.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.809 179.699 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -93.51 -79.66 0.4 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.521 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.42 ' O ' ' CE1' ' A' ' 91' ' ' TYR . 7.0 p90 -129.73 141.44 50.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.807 0.337 . . . . 0.0 111.324 -179.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -104.05 110.38 22.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.748 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.6 tttt -58.83 -35.23 72.57 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.903 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 106.16 28.04 5.38 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.431 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -106.97 161.7 14.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.79 0.329 . . . . 0.0 110.839 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.77 45.15 2.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.883 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 1.8 p -95.88 126.49 41.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.945 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -115.12 -50.85 2.74 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.948 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -104.64 -21.67 13.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.139 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -55.45 -30.64 60.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.235 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 125.19 51.35 0.18 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.535 -0.841 . . . . 0.0 112.554 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 1.7 ttt85 -58.75 112.85 1.78 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.883 0.373 . . . . 0.0 110.959 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -105.32 22.07 33.72 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.779 -0.725 . . . . 0.0 112.561 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.417 ' HB3' ' CE2' ' A' ' 91' ' ' TYR . 38.2 mt -78.06 148.02 34.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.715 0.293 . . . . 0.0 110.695 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -105.95 134.29 49.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.033 0.444 . . . . 0.0 111.502 -179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.52 ' CD2' ' CD1' ' A' ' 34' ' ' PHE . 96.9 m-85 -142.12 90.22 2.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.456 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 25.3 mm -133.82 116.89 24.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.983 0.421 . . . . 0.0 111.818 -179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -151.13 117.78 5.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.326 179.219 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.493 ' CA ' ' HB2' ' A' ' 71' ' ' LYS . . . -94.38 113.36 25.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.679 -179.349 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.488 ' N ' ' HB2' ' A' ' 71' ' ' LYS . 16.3 t70 49.97 25.91 1.82 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.985 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.41 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.237 -179.762 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.856 0.36 . . . . 0.0 110.811 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.97 141.17 34.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.865 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -93.63 159.07 15.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.846 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.4 mttp -75.86 107.9 8.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.021 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -139.13 143.54 37.11 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.521 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.461 ' HA ' ' HA ' ' A' ' 73' ' ' GLU . 84.2 Cg_endo -83.75 164.37 13.98 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.476 2.117 . . . . 0.0 112.711 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -119.29 104.69 10.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.999 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 44.7 p -64.69 80.94 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.273 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tt -69.7 120.96 16.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.431 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 26.4 mt -125.27 -69.86 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.7 pttt -121.68 145.95 47.5 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.925 0.393 . . . . 0.0 111.435 -179.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -124.08 147.52 47.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.868 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.48 HG22 HD13 ' A' ' 18' ' ' ILE . 42.6 mm -96.81 -88.92 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.346 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -118.25 107.32 13.77 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.8 0.333 . . . . 0.0 111.045 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 98.67 -113.99 4.89 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.447 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -123.25 16.39 9.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.599 0.237 . . . . 0.0 111.159 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.6 t -74.85 106.78 6.55 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.893 0.378 . . . . 0.0 110.725 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.8 t -128.77 134.67 63.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.966 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.73 97.86 6.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.707 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.38 142.53 30.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.867 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.76 100.0 3.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.915 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -96.73 100.42 11.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.873 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.9 tttm 56.31 31.35 18.43 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.988 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 90.54 20.92 39.12 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.823 -0.704 . . . . 0.0 112.576 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.89 112.5 6.88 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.572 0.225 . . . . 0.0 110.778 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.2 129.49 21.8 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.351 2.034 . . . . 0.0 112.358 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.412 ' HB3' ' CZ ' ' A' ' 34' ' ' PHE . 33.6 mmm -145.04 118.7 9.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.933 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.409 ' O ' ' CD1' ' A' ' 34' ' ' PHE . 0.8 OUTLIER -70.38 135.34 48.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.077 -179.966 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.424 ' HB3' ' CB ' ' A' ' 90' ' ' ALA . 27.0 m-85 -140.69 152.75 45.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.907 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtt-85 -117.3 148.0 42.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.972 0.415 . . . . 0.0 111.081 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 35.0 tp -78.06 138.39 38.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.786 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.421 ' HB2' ' CE1' ' A' ' 91' ' ' TYR . 8.5 tt -82.83 94.34 7.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.804 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.909 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.807 0.337 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.7 p -69.52 -24.54 63.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.238 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -54.72 -23.51 18.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.613 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.408 ' CE2' ' HE2' ' A' ' 65' ' ' MET . 16.1 m-85 -55.1 -31.11 60.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.815 0.34 . . . . 0.0 111.198 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 13.0 t -79.07 -17.48 55.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.279 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 67' ' ' GLU . 0.5 OUTLIER -89.41 -57.28 2.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.847 0.356 . . . . 0.0 111.441 -179.73 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.0 mtmp? -88.65 -59.18 2.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.205 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.462 ' HA ' ' CB ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -55.67 -20.36 13.86 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.664 -179.347 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . 0.447 ' CE2' ' CG ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -99.22 -33.71 10.65 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.359 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.421 ' HB2' ' O ' ' A' ' 63' ' ' LYS . 5.2 mt-10 -94.0 -56.32 2.91 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 -179.534 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -80.17 -28.87 38.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.892 0.377 . . . . 0.0 110.991 -179.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.462 ' CB ' ' HA ' ' A' ' 65' ' ' MET . . . -108.78 152.6 24.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.698 179.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.48 163.74 0.4 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.46 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.447 ' CG ' ' CE2' ' A' ' 66' ' ' TRP . 0.1 OUTLIER -84.9 162.06 19.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.108 0.48 . . . . 0.0 111.486 -178.622 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 1.1 pp -102.83 145.22 12.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.849 -179.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.461 ' HA ' ' HA ' ' A' ' 11' ' ' PRO . 44.5 mt-10 -127.89 179.1 5.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.634 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.6 p -112.34 140.97 29.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.907 0.384 . . . . 0.0 111.055 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -106.88 -66.89 0.98 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.02 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 35.8 p90 -143.0 129.35 19.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.947 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.53 157.84 15.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.993 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -49.56 77.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.811 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 64.0 32.28 83.65 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.591 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -101.57 9.39 41.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.614 0.245 . . . . 0.0 111.315 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 26.4 mtm180 54.57 95.43 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.714 0.292 . . . . 0.0 111.175 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 41.7 m -62.2 148.98 42.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.908 0.385 . . . . 0.0 110.664 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -115.29 -40.18 3.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.287 -179.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.41 -63.11 1.02 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.245 -179.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -127.36 -35.15 2.21 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.15 -179.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 109.56 49.8 0.73 Allowed Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.728 -0.749 . . . . 0.0 111.845 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . 0.402 ' HB2' ' CZ ' ' A' ' 87' ' ' ARG . 2.5 mtm105 -131.92 101.77 5.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.782 0.325 . . . . 0.0 111.022 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -48.83 171.44 0.07 OUTLIER Glycine 0 CA--C 1.518 0.26 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.415 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.4 mp -111.19 112.66 24.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.84 0.352 . . . . 0.0 111.192 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.424 ' CB ' ' HB3' ' A' ' 34' ' ' PHE . . . -128.62 130.08 46.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.798 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.421 ' CE1' ' HB2' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -98.85 149.82 22.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.066 -179.762 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 2.7 pp -79.88 160.12 4.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.056 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -140.85 168.23 20.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.947 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.84 112.52 24.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.996 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.9 p30 45.21 41.93 6.46 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.412 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.29 0 C-N-CA 120.657 -0.783 . . . . 0.0 112.673 179.955 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.6 tptt . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.826 0.346 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.4 120.26 21.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.005 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . 0.414 ' CE1' ' OH ' ' A' ' 27' ' ' TYR . 12.8 p-80 -70.99 157.19 38.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.703 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.6 mmtp -94.98 112.65 24.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.423 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.0 113.75 32.67 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.246 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.465 ' HA ' ' O ' ' A' ' 72' ' ' ILE . 83.1 Cg_endo -86.65 109.31 0.85 Allowed 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.513 2.142 . . . . 0.0 113.223 -178.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -166.42 -78.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.556 179.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.509 ' HA ' ' HB2' ' A' ' 25' ' ' LEU . 30.1 p 41.88 28.74 0.1 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 179.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -98.16 85.55 3.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.857 0.36 . . . . 0.0 110.563 179.411 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 10.5 mm -126.29 -69.81 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.88 179.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -141.85 173.04 11.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.304 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -122.35 140.0 53.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.034 0.445 . . . . 0.0 111.554 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 7.8 tt -173.6 164.23 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.768 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.42 171.97 5.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.784 0.326 . . . . 0.0 110.872 -179.656 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -60.86 82.98 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.617 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -147.27 -49.66 0.18 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.083 0.468 . . . . 0.0 110.47 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 t -172.06 106.58 0.2 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.515 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.473 ' O ' ' HA ' ' A' ' 33' ' ' THR . 35.9 m -122.52 127.59 75.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.122 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.465 ' HA ' ' HA ' ' A' ' 33' ' ' THR . 0.2 OUTLIER -79.21 133.99 36.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.864 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.509 ' HB2' ' HA ' ' A' ' 13' ' ' THR . 0.5 OUTLIER -126.29 148.08 49.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.632 179.975 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.74 101.81 3.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.054 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.414 ' OH ' ' CE1' ' A' ' 8' ' ' HIS . 3.0 t80 -119.81 120.53 36.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.745 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.3 pttt 49.09 28.11 1.98 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.341 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.65 10.36 85.91 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.82 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.4 ' HA ' ' HD3' ' A' ' 31' ' ' PRO . 1.7 mm-40 -121.97 142.46 36.44 Favored Pre-proline 0 CA--C 1.53 0.197 0 CA-C-N 116.726 0.263 . . . . 0.0 110.888 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 30' ' ' GLN . 35.0 Cg_exo -59.87 127.56 23.83 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.493 2.129 . . . . 0.0 112.264 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.486 ' HB3' ' CE1' ' A' ' 34' ' ' PHE . 25.6 mmt -145.21 110.75 5.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.782 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.473 ' HA ' ' O ' ' A' ' 23' ' ' VAL . 1.6 t -101.41 86.93 3.08 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.878 0.37 . . . . 0.0 111.829 -179.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.667 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -113.48 107.65 16.11 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.961 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.794 ' HA ' ' O ' ' A' ' 90' ' ' ALA . 16.5 tpt180 -143.88 95.01 2.66 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.202 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.468 ' CB ' ' HB3' ' A' ' 89' ' ' LEU . 0.1 OUTLIER -145.39 88.42 1.86 Allowed 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.386 178.551 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.2 pp -110.02 126.35 53.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.003 0.43 . . . . 0.0 110.754 179.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.641 -179.352 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.081 0 CA-C-O 120.862 0.363 . . . . 0.0 111.106 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.7 t -77.73 -16.02 58.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.406 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -50.89 -29.52 12.17 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.827 0.346 . . . . 0.0 111.5 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -57.48 -34.82 69.43 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.867 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.522 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 29.3 p -91.17 -15.29 29.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.215 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.436 ' O ' ' HB2' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -89.69 -56.96 3.04 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -179.264 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.8 tmtt? -89.18 -64.57 1.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.427 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 0.5 OUTLIER -59.43 -20.47 55.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.464 -178.311 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' TRP . . . . . 0.522 ' HB3' ' O ' ' A' ' 62' ' ' THR . 23.9 t90 -99.39 -33.83 10.54 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -179.067 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.436 ' HB2' ' O ' ' A' ' 63' ' ' LYS . 9.7 mm-40 -94.12 -53.57 3.91 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 -179.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -79.75 -28.32 40.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.654 0.264 . . . . 0.0 111.578 -178.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.428 ' HB1' ' HD3' ' A' ' 71' ' ' LYS . . . -108.23 151.29 26.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.813 0.339 . . . . 0.0 111.23 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.1 mtmp? -97.94 94.83 7.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.274 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.478 ' HB2' ' N ' ' A' ' 95' ' ' ASP . 0.0 OUTLIER -164.45 98.95 0.81 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.502 179.567 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.465 ' O ' ' HA ' ' A' ' 11' ' ' PRO . 0.0 OUTLIER -133.48 127.48 53.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.12 179.864 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -162.87 158.26 22.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.735 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.3 m -133.54 152.52 35.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.145 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -157.54 93.55 1.3 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.864 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.492 ' CE2' ' CD2' ' A' ' 34' ' ' PHE . 42.0 p90 -143.13 118.11 10.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.155 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -91.91 91.9 8.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.606 179.683 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.412 ' CD ' HD13 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -94.52 -68.83 0.78 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.126 -179.719 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 64.13 27.31 71.27 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.352 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -129.18 116.05 18.61 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.977 0.418 . . . . 0.0 110.8 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.36 102.04 0.16 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.916 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.41 ' HB ' ' HA2' ' A' ' 86' ' ' GLY . 26.7 m -58.77 149.12 27.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.44 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -115.74 -48.78 2.75 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -178.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.33 -63.17 0.58 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.309 -0.405 . . . . 0.0 112.049 -178.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -133.31 -35.33 1.03 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.788 0.328 . . . . 0.0 111.25 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . 0.41 ' HA2' ' HB ' ' A' ' 82' ' ' THR . . . 120.55 34.61 0.92 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.816 -179.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -138.89 120.38 15.02 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.104 0.478 . . . . 0.0 110.945 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -75.01 -140.16 0.7 Allowed Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 115.791 -0.64 . . . . 0.0 112.759 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.468 ' HB3' ' CB ' ' A' ' 36' ' ' LEU . 3.4 mp -128.46 116.01 19.05 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 122.109 0.163 . . . . 0.0 111.134 -179.409 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.794 ' O ' ' HA ' ' A' ' 35' ' ' ARG . . . -136.33 161.98 34.3 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 178.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.497 ' CD1' ' N ' ' A' ' 91' ' ' TYR . 0.0 OUTLIER -132.07 158.07 42.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.403 -178.874 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 2.4 pp -79.94 148.16 6.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.342 -179.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -140.17 129.69 24.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.878 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.416 ' HA ' ' HB2' ' A' ' 71' ' ' LYS . . . -83.98 110.23 18.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.378 -179.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.478 ' N ' ' HB2' ' A' ' 71' ' ' LYS . 1.5 t70 60.72 20.22 10.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.685 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.518 -179.939 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.755 0.312 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.2 t -85.94 113.1 21.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.886 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.3 t -75.28 114.07 13.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.918 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.76 123.55 28.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.764 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.2 ttpp -72.32 107.09 4.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.026 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -109.0 121.3 44.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.669 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.412 ' CD1' ' CD ' ' A' ' 9' ' ' LYS . 1.5 pp -87.8 120.34 29.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.115 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -81.39 88.8 6.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.515 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.474 ' HG2' ' CG1' ' A' ' 74' ' ' VAL . 1.8 tttt -88.11 159.45 18.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.409 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.16 165.39 13.69 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.202 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.473 ' HB3' ' CG ' ' A' ' 73' ' ' GLU . 93.2 Cg_endo -77.55 163.14 29.81 Favored 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.347 2.031 . . . . 0.0 112.289 -178.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.428 ' CB ' ' HB3' ' A' ' 25' ' ' LEU . . . -115.56 -165.38 1.03 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.13 0.491 . . . . 0.0 111.716 -179.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.5 p -116.36 -174.89 2.64 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.06 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 61.1 tp -98.34 113.86 25.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.814 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 22.4 mm -125.18 -43.88 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.914 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -142.12 141.54 32.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.716 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -127.01 119.32 26.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.153 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.472 HD12 HG21 ' A' ' 18' ' ' ILE . 23.7 mt -150.61 152.88 11.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.096 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -68.6 76.8 0.29 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.893 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 48.51 74.05 0.29 Allowed Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.529 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -147.8 -48.7 0.17 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.129 0.49 . . . . 0.0 110.575 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 t -169.87 106.57 0.35 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.676 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.426 ' O ' ' HA ' ' A' ' 33' ' ' THR . 41.5 t -127.24 113.42 32.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.526 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.38 127.47 32.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.264 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.428 ' HB3' ' CB ' ' A' ' 12' ' ' ALA . 7.1 mp -114.6 139.06 49.92 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.334 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.86 99.39 2.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.914 0.388 . . . . 0.0 110.793 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -116.36 115.39 25.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.751 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.3 ttmp? 63.84 25.23 13.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.013 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 93.88 -13.97 66.29 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.642 -0.789 . . . . 0.0 112.884 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -112.3 139.45 22.55 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.835 0.318 . . . . 0.0 111.011 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -79.21 139.02 14.61 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.684 2.256 . . . . 0.0 112.419 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.469 ' CB ' ' CZ ' ' A' ' 34' ' ' PHE . 3.1 mmt -139.34 128.22 23.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.935 0.397 . . . . 0.0 111.029 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.426 ' HA ' ' O ' ' A' ' 23' ' ' VAL . 86.7 m -79.31 127.8 32.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.905 -179.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.627 ' HB3' ' CB ' ' A' ' 90' ' ' ALA . 38.0 m-85 -141.33 130.92 23.98 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.45 179.083 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -143.33 96.26 2.89 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.608 ' O ' ' CD1' ' A' ' 91' ' ' TYR . 0.2 OUTLIER -144.34 87.29 1.87 Allowed 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.364 177.497 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -145.71 103.9 3.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.931 0.396 . . . . 0.0 111.267 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 55.9 mt -149.88 113.03 4.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.006 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 19.3 t -142.0 126.5 16.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.998 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -135.24 100.27 4.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.114 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 35.9 m -157.12 101.08 1.93 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.841 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.36 163.05 40.14 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.437 2.091 . . . . 0.0 112.507 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -73.33 -16.24 61.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.382 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -60.84 151.16 30.65 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.677 0.275 . . . . 0.0 110.772 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 4.1 mtmt -45.36 -58.36 3.38 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.232 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -87.31 106.99 12.8 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.407 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.73 105.45 0.94 Allowed 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.241 1.961 . . . . 0.0 112.333 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.45 96.82 4.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.691 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 16.1 mtmm 55.22 98.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.99 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.41 -145.88 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.596 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 18.7 m -71.13 144.43 13.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.782 0.325 . . . . 0.0 111.191 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.99 -177.94 3.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.835 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.93 95.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.846 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -67.73 -34.04 76.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.986 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 172.08 166.33 30.56 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.55 -0.834 . . . . 0.0 112.843 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.29 -2.42 12.61 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.826 2.35 . . . . 0.0 112.806 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -44.0 -28.03 0.43 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.843 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.418 ' HA ' ' CD2' ' A' ' 61' ' ' PHE . . . -45.61 -49.09 14.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.84 0.352 . . . . 0.0 111.412 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.2 p -54.0 -22.14 9.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.545 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -86.02 -31.2 22.13 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.861 0.362 . . . . 0.0 110.768 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.484 ' CA ' ' HB2' ' A' ' 65' ' ' MET . 19.0 m-30 -55.56 -30.59 61.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.743 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.555 ' HA ' ' HB2' ' A' ' 66' ' ' TRP . 0.0 OUTLIER -63.68 -14.79 55.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.549 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.7 mtpt -90.94 -68.36 0.8 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.139 0.495 . . . . 0.0 111.418 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.1 mttt -87.96 -51.49 5.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.084 -179.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.489 ' O ' ' O ' ' A' ' 69' ' ' ALA . 2.1 mmt -63.63 -13.98 47.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.568 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . 0.555 ' HB2' ' HA ' ' A' ' 62' ' ' THR . 18.8 t90 -83.56 -34.96 25.09 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 121.392 0.615 . . . . 0.0 109.668 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -94.34 -22.99 17.99 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.118 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -114.1 -28.15 7.42 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.489 ' O ' ' O ' ' A' ' 65' ' ' MET . . . -108.22 154.66 21.44 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.39 -178.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.473 ' O ' ' N ' ' A' ' 95' ' ' ASP . 0.0 OUTLIER -51.24 100.45 0.03 OUTLIER 'General case' 0 C--O 1.225 -0.188 0 CA-C-O 122.059 0.933 . . . . 0.0 108.676 -179.828 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.528 ' HB3' ' HA ' ' A' ' 66' ' ' TRP . 0.0 OUTLIER -84.97 174.41 9.79 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.312 -1.313 . . . . 0.0 114.019 -176.377 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.544 HG21 ' N ' ' A' ' 93' ' ' TYR . 23.1 pt -63.96 141.05 18.69 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.21 0 CA-C-O 122.278 1.037 . . . . 0.0 113.757 -175.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.473 ' CG ' ' HB3' ' A' ' 11' ' ' PRO . 41.2 mt-10 -158.78 157.57 31.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 113.371 -1.741 . . . . 0.0 107.927 179.46 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.474 ' CG1' ' HG2' ' A' ' 9' ' ' LYS . 1.7 p -100.85 145.12 11.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.359 -0.536 . . . . 0.0 111.073 -179.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.414 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -125.79 -69.25 0.79 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.534 -179.197 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.414 ' CD1' ' HB3' ' A' ' 75' ' ' GLU . 12.6 p90 -138.67 156.4 47.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.947 0.403 . . . . 0.0 111.236 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -104.03 158.47 16.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.823 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.9 tptt -87.42 -40.72 14.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.044 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 106.02 26.46 6.04 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.573 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -118.56 -40.47 2.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.907 0.384 . . . . 0.0 110.701 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.505 ' HG3' ' N ' ' A' ' 82' ' ' THR . 0.0 OUTLIER 80.04 -54.76 0.38 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.191 179.848 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.505 ' N ' ' HG3' ' A' ' 81' ' ' ARG . 1.3 t -110.04 120.61 43.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.651 0.262 . . . . 0.0 111.078 179.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -115.54 -51.58 2.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.261 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.34 -63.22 1.41 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.195 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -103.51 -35.2 8.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.898 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.459 ' HA2' ' CB ' ' A' ' 82' ' ' THR . . . 108.61 51.09 0.72 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.005 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 61.5 mtt-85 -130.43 97.85 4.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.909 0.385 . . . . 0.0 111.208 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.425 ' HA3' ' O ' ' A' ' 33' ' ' THR . . . 53.01 168.38 0.02 OUTLIER Glycine 0 C--N 1.331 0.255 0 CA-C-N 115.919 -0.582 . . . . 0.0 113.136 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.452 ' O ' ' HG ' ' A' ' 89' ' ' LEU . 1.0 OUTLIER -128.74 97.93 4.83 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.542 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.627 ' CB ' ' HB3' ' A' ' 34' ' ' PHE . . . -165.46 148.0 7.75 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.064 0.459 . . . . 0.0 111.659 178.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.662 ' CD1' ' N ' ' A' ' 91' ' ' TYR . 0.1 OUTLIER -92.5 136.96 32.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.906 -177.665 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.452 ' CG2' HG22 ' A' ' 72' ' ' ILE . 2.5 mp -89.52 109.62 20.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.318 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.544 ' N ' HG21 ' A' ' 72' ' ' ILE . 3.5 m-85 -88.41 117.49 27.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.86 0.362 . . . . 0.0 110.613 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -113.47 121.26 43.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.914 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' A' ' 70' ' ' LYS . 4.6 p-10 44.78 44.56 7.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.078 0.466 . . . . 0.0 110.838 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.44 ' N ' ' O ' ' A' ' 70' ' ' LYS . . . 52.32 18.36 4.9 Favored Glycine 0 CA--C 1.52 0.365 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.931 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -137.55 120.88 16.96 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.658 0.266 . . . . 0.0 110.759 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 2.7 mpp? -65.75 121.59 15.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.659 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 10.9 p -57.4 -34.62 46.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.094 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 61.32 103.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.982 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -135.15 118.8 17.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.816 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -166.24 135.64 3.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.236 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 32.4 mt 59.69 165.32 0.06 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.991 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.81 99.53 5.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.021 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 66.77 -73.97 0.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.752 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -147.81 -47.15 0.16 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.831 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -154.5 67.72 0.31 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.519 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 14.2 tp 61.71 45.16 8.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.81 0.338 . . . . 0.0 110.791 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 60.94 85.95 0.11 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.146 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.232 -0.889 . . . . 0.0 110.91 -179.992 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.831 0.348 . . . . 0.0 111.0 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 68.1 p -101.86 125.83 48.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.861 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 44.8 t -69.28 128.6 37.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.857 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -106.5 148.38 28.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.934 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.56 138.61 48.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.903 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.1 115.11 24.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.014 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.437 HD22 ' CD2' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -84.06 151.08 25.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.72 -179.997 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 7.3 m80 -117.81 136.56 53.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.934 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -116.94 116.25 27.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.953 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.422 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 0.4 OUTLIER -155.14 145.48 15.95 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.159 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.401 ' CB ' HG12 ' A' ' 72' ' ' ILE . 73.7 Cg_endo -78.44 141.1 17.62 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.14 1.893 . . . . 0.0 112.526 -179.533 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -115.32 -165.42 1.03 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.031 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.03 -168.86 1.68 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.976 0.417 . . . . 0.0 111.276 -179.501 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.86 157.27 2.45 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.417 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.455 ' CG2' ' HB3' ' A' ' 25' ' ' LEU . 1.2 pp -112.03 -179.12 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.089 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.76 172.97 6.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.837 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.47 126.81 52.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.116 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.7 mm -141.41 158.17 21.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.214 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 12.9 p-10 -72.96 66.42 0.79 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.81 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 160.88 -130.55 2.39 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.361 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 -113.09 -15.26 12.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.696 0.284 . . . . 0.0 110.887 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 31.1 p -54.6 109.08 0.45 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.97 0.414 . . . . 0.0 111.424 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.405 ' HB ' ' CG2' ' A' ' 15' ' ' ILE . 35.3 m -122.73 118.89 56.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.619 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.86 106.49 16.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.492 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.455 ' HB3' ' CG2' ' A' ' 15' ' ' ILE . 0.3 OUTLIER -118.76 164.95 14.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.593 179.513 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 2.4 ttp -79.95 99.8 7.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.567 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.423 ' CD1' ' HB2' ' A' ' 28' ' ' LYS . 51.1 t80 -124.27 133.43 53.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.998 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.423 ' HB2' ' CD1' ' A' ' 27' ' ' TYR . 0.0 OUTLIER 57.37 28.68 15.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.93 179.988 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.54 4.91 85.48 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.941 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -136.78 143.9 44.61 Favored Pre-proline 0 C--N 1.332 -0.163 0 CA-C-N 116.737 0.269 . . . . 0.0 111.008 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.39 130.12 14.68 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.523 2.148 . . . . 0.0 112.28 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.42 ' HB2' ' CE2' ' A' ' 34' ' ' PHE . 8.3 mtt -139.67 134.24 31.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.004 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.54 129.3 35.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.834 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.42 ' CE2' ' HB2' ' A' ' 32' ' ' MET . 60.8 m-85 -138.73 158.23 44.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.972 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 -102.43 120.86 41.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.763 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -44.57 151.52 0.27 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.239 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.9 pp -59.52 138.24 57.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.029 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 27.4 mt -133.58 168.04 19.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.803 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 38.5 t -61.94 156.59 3.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.016 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -83.58 129.52 34.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.018 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 72.9 m -115.79 93.52 37.9 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.741 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -63.38 162.96 25.17 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.734 2.29 . . . . 0.0 112.298 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -73.52 -165.17 0.24 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.857 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 m -70.16 151.08 45.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.023 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.55 22.08 12.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.081 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.459 ' CB ' ' HD2' ' A' ' 47' ' ' PRO . 1.3 m-70 -121.19 168.01 11.96 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.634 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.459 ' HD2' ' CB ' ' A' ' 46' ' ' HIS . 2.5 Cg_endo -45.66 156.2 0.43 Allowed 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.856 2.371 . . . . 0.0 112.302 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.21 152.61 0.56 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.367 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 2.5 ptpt -103.93 -177.77 3.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.932 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -101.31 -122.64 5.04 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.483 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 20.6 t -121.04 159.2 23.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.887 0.375 . . . . 0.0 111.066 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -103.35 176.38 5.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.918 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.19 94.91 0.54 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.886 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.438 ' CE1' ' CB ' ' A' ' 57' ' ' GLU . 1.5 p90 -82.48 -26.83 32.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.073 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 152.07 -153.44 24.91 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.768 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.44 -2.87 13.11 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.666 2.244 . . . . 0.0 112.793 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.438 ' CB ' ' CE1' ' A' ' 54' ' ' TYR . 0.1 OUTLIER -50.07 -27.63 5.9 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.778 0.323 . . . . 0.0 111.042 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.51 -31.64 62.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.024 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.2 p -63.5 -28.61 70.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.956 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -55.13 -26.15 36.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.312 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -57.17 -31.53 65.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.076 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.476 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 44.6 p -87.11 -21.77 25.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.11 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.456 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 5.0 mtmt -89.18 -19.99 24.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.206 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.76 -64.26 1.17 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.779 -179.293 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 9.9 mmm -89.16 -52.97 4.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.8 -178.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . 0.476 ' HB3' ' O ' ' A' ' 62' ' ' THR . 83.5 t90 -62.11 -15.54 46.11 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.263 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.456 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 22.4 tt0 -89.57 -51.97 5.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.799 0.333 . . . . 0.0 111.15 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -80.02 -28.15 39.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.146 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -108.07 150.91 26.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.837 0.351 . . . . 0.0 111.186 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.8 mtpt -98.28 96.46 8.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.828 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.23 125.11 22.62 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.207 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.401 HG12 ' CB ' ' A' ' 11' ' ' PRO . 0.3 OUTLIER -88.01 154.1 3.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.264 179.263 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -134.28 151.36 51.23 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.422 ' HB ' ' O ' ' A' ' 10' ' ' GLU . 7.5 p -126.47 153.22 34.86 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.7 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.419 ' HG2' ' CD2' ' A' ' 34' ' ' PHE . 2.5 mp0 -100.98 166.86 10.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.904 0.383 . . . . 0.0 111.166 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.51 ' CG ' ' CZ ' ' A' ' 91' ' ' TYR . 6.3 m-30 -93.0 168.1 11.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.875 -179.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -96.89 91.91 5.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.715 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.85 -28.14 50.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.96 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 68.21 25.17 74.68 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.38 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.06 84.49 2.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.876 0.369 . . . . 0.0 110.587 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 61.0 ttt180 -50.95 100.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.07 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.4 p -58.79 120.9 9.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.596 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -115.31 -45.44 2.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.374 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.09 -50.33 11.11 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.198 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -133.0 -35.04 1.07 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.233 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 97.73 46.87 2.21 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.815 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 21.9 mtm180 -133.47 99.16 4.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.837 0.351 . . . . 0.0 111.307 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -85.07 -121.46 1.03 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.371 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.2 mt -128.18 128.19 44.32 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.843 0.354 . . . . 0.0 110.965 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.42 ' C ' ' CD1' ' A' ' 91' ' ' TYR . . . -111.56 148.67 32.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.263 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.51 ' CZ ' ' CG ' ' A' ' 76' ' ' PHE . 1.6 m-85 -137.07 158.28 44.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.339 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 2.0 pp -124.85 111.75 29.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.862 0.363 . . . . 0.0 111.623 -179.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -98.71 134.44 41.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.602 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.47 110.84 22.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.286 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.2 t0 47.82 30.47 1.91 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.168 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.43 131.96 0.32 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.352 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 37.9 tttt -86.86 103.52 15.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.777 0.322 . . . . 0.0 110.901 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -92.35 130.32 38.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.82 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 21.4 t -88.69 149.96 3.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.091 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 18.1 p30 -121.2 174.7 6.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.91 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -131.36 -53.29 1.02 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.908 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -149.99 111.98 4.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.131 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -107.5 -31.95 7.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.9 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 3.5 m -122.51 103.36 13.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.005 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -155.32 60.47 0.63 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.916 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 69.03 -67.25 0.22 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.945 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -58.26 -34.45 74.15 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.511 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.2 mp -118.65 60.32 0.8 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.964 0.411 . . . . 0.0 110.822 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 62.96 144.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.137 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 2.4 tmtt? . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.842 -179.956 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.769 0.319 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.0 t -103.77 94.53 5.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.85 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.7 m -102.54 146.68 27.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.952 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.43 152.62 40.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.878 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -59.7 120.45 9.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.899 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.14 150.98 36.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.069 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.9 pp -73.1 157.0 38.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.958 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 5.2 m170 -80.07 124.81 29.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.711 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 ptpt -101.09 107.73 19.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.939 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -155.14 120.84 2.62 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.796 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -78.72 146.81 21.4 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.299 1.999 . . . . 0.0 112.124 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -127.83 -86.78 0.57 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.347 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.425 ' HA ' HG13 ' A' ' 72' ' ' ILE . 0.1 OUTLIER 167.57 119.77 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.678 0.275 . . . . 0.0 110.991 -179.908 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.9 tp -85.8 155.84 20.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.202 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.7 mt -125.2 -72.34 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -120.23 146.51 45.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.893 0.377 . . . . 0.0 111.289 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.405 ' HA ' ' CG1' ' A' ' 23' ' ' VAL . . . -127.1 97.94 5.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.941 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.7 pt -64.62 -164.23 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.108 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -69.14 63.4 0.13 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.644 0.259 . . . . 0.0 111.499 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 42.58 70.21 0.52 Allowed Glycine 0 CA--C 1.519 0.289 0 C-N-CA 121.23 -0.51 . . . . 0.0 113.295 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -147.09 -39.57 0.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.592 0.234 . . . . 0.0 111.128 179.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.7 t -169.5 120.74 0.7 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.867 0.365 . . . . 0.0 111.144 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.526 ' O ' ' HA ' ' A' ' 33' ' ' THR . 33.6 m -117.66 131.73 69.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.885 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.407 ' HB3' ' HB ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -79.13 147.35 32.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.924 0.392 . . . . 0.0 111.209 -179.572 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.1 tp -141.01 125.37 17.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.82 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 7.7 mtt -72.92 99.82 2.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.821 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -125.67 126.94 45.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.965 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.53 33.23 20.65 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.085 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.21 20.67 73.35 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.457 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -134.66 119.71 14.08 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.542 0.21 . . . . 0.0 110.84 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -59.72 133.52 51.77 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.401 2.067 . . . . 0.0 112.431 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.6 ' HB3' ' CE2' ' A' ' 34' ' ' PHE . 15.2 mmt -132.33 110.16 10.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.155 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.526 ' HA ' ' O ' ' A' ' 23' ' ' VAL . 8.8 t -120.69 86.3 2.55 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -179.125 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.6 ' CE2' ' HB3' ' A' ' 32' ' ' MET . 1.7 p90 -142.09 106.26 4.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.438 177.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 13.4 ttp180 -140.55 97.08 3.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.634 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.426 ' CD1' ' HA2' ' A' ' 88' ' ' GLY . 0.5 OUTLIER -142.54 88.78 2.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.894 0.378 . . . . 0.0 110.75 178.971 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -133.03 93.73 3.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.794 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.451 ' CD1' ' N ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -148.48 177.05 9.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.841 179.902 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 16.1 m -93.92 144.42 9.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.165 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -105.43 128.48 53.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.906 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -105.34 147.78 35.16 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.859 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -72.06 147.8 49.46 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.643 2.228 . . . . 0.0 112.288 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -103.01 32.99 3.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.886 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -106.78 113.28 26.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.9 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 68.99 -67.37 0.22 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.046 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 42.9 m-70 -84.01 143.14 42.4 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.929 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.07 155.97 42.65 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.614 2.209 . . . . 0.0 112.356 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.0 152.04 45.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.835 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.55 29.4 0.38 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.025 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -105.25 -53.32 0.79 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.49 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.8 t -101.63 85.81 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.776 0.322 . . . . 0.0 111.133 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.0 150.96 26.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.894 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.56 94.61 0.43 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.857 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -56.22 -34.09 65.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.996 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 69.62 -147.64 45.58 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.635 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -54.19 -21.97 24.24 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.634 2.222 . . . . 0.0 112.603 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -54.18 -54.4 40.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.23 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.52 -52.23 66.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.249 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.3 m -62.35 -30.8 71.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.089 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.62 -30.47 71.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.232 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 35.3 t80 -71.97 -42.07 66.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.041 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.41 ' CA ' ' HB3' ' A' ' 66' ' ' TRP . 81.1 p -76.11 -48.82 19.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.928 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.454 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -53.8 -21.33 7.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.442 -179.949 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.51 -60.86 1.85 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.301 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.426 ' O ' ' N ' ' A' ' 69' ' ' ALA . 18.9 mtm -90.12 -51.97 5.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.91 -179.145 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . 0.41 ' HB3' ' CA ' ' A' ' 62' ' ' THR . 64.3 t90 -59.99 -33.0 71.38 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -178.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.454 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -74.44 -50.19 19.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.741 0.305 . . . . 0.0 111.659 -179.365 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -79.8 -28.67 40.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.429 -179.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.426 ' N ' ' O ' ' A' ' 65' ' ' MET . . . -108.47 148.5 30.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.224 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.9 mmmm -104.25 92.81 4.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.444 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -140.4 98.81 3.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.974 -179.776 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.431 ' CD1' ' N ' ' A' ' 72' ' ' ILE . 0.0 OUTLIER -139.66 131.44 33.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.18 0.514 . . . . 0.0 111.767 179.883 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -165.18 178.97 6.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.014 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.7 t -100.9 136.36 32.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.756 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -130.84 -5.91 4.02 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -179.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.641 ' HB3' ' O ' ' A' ' 90' ' ' ALA . 2.7 p90 -92.14 137.86 32.01 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.129 0.49 . . . . 0.0 111.771 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -104.58 91.83 4.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.229 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.8 tptp -78.41 -71.93 0.4 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.193 -179.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 95.62 -27.74 14.77 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.244 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.9 -163.35 0.47 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.622 0.248 . . . . 0.0 110.568 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -119.1 18.27 13.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.474 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 16.4 p -109.07 120.04 41.34 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.909 0.385 . . . . 0.0 111.011 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.534 ' O ' ' HB3' ' A' ' 87' ' ' ARG . 4.7 m-20 -116.92 -52.15 2.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.316 0.579 . . . . 0.0 109.665 178.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 4.5 mtpt -111.19 -32.94 6.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.675 178.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 46.0 m-85 -87.69 46.48 1.38 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.884 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 130.44 44.04 0.18 Allowed Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.951 -0.642 . . . . 0.0 111.57 -179.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.534 ' HB3' ' O ' ' A' ' 83' ' ' ASP . 0.0 OUTLIER -57.8 132.97 54.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.137 0.494 . . . . 0.0 110.229 179.394 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.426 ' HA2' ' CD1' ' A' ' 36' ' ' LEU . . . -129.92 -35.72 0.42 Allowed Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.703 -0.761 . . . . 0.0 113.538 -179.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.573 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER -103.46 148.47 25.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.819 0.342 . . . . 0.0 111.554 -179.14 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.641 ' O ' ' HB3' ' A' ' 76' ' ' PHE . . . -118.62 147.19 44.0 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.435 0.532 . . . . 0.0 112.435 -179.105 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -116.04 144.99 43.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.016 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 1.3 tt -150.11 113.57 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.84 179.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -108.07 123.44 48.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.069 0.462 . . . . 0.0 111.156 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -134.18 91.8 2.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.158 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 38.4 t70 50.39 58.07 5.9 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.484 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 80.64 -61.64 4.46 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.764 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 4.5 mtpm? -111.83 121.92 46.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.888 0.375 . . . . 0.0 110.942 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 1.4 ptt? -72.28 110.04 6.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.733 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 29.3 m -127.58 127.57 68.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.249 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -90.87 -51.42 5.36 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.88 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -114.28 112.26 22.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.869 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.27 129.07 37.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.195 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 mp -127.05 164.9 20.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.887 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.5 t 61.47 96.25 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.024 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -135.74 -65.27 0.6 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.931 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -94.39 -34.33 12.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.943 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 115.16 36.08 1.26 Allowed Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.46 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.8 tp -84.31 -30.26 25.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.838 0.351 . . . . 0.0 110.979 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 61.67 162.3 0.07 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.168 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.842 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.299 0 CA-C-O 120.75 0.309 . . . . 0.0 111.118 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -104.63 101.55 11.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.791 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 25.8 t -65.81 129.03 38.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.915 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 64.0 p -91.54 144.54 25.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.939 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 31.8 mmtt -63.71 132.93 52.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.943 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -93.27 123.13 36.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.93 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.05 157.13 38.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.93 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -79.71 155.04 28.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.707 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.79 132.17 39.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.185 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -155.03 120.13 2.59 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.767 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -80.27 170.96 15.57 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.507 2.138 . . . . 0.0 112.685 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.479 ' O ' ' CB ' ' A' ' 13' ' ' THR . . . -136.57 -80.3 0.4 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.742 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.479 ' CB ' ' O ' ' A' ' 12' ' ' ALA . 3.8 m 90.43 -69.36 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.651 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.49 87.02 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.818 0.342 . . . . 0.0 111.272 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.47 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 2.6 pp -125.48 -179.1 2.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.114 0.483 . . . . 0.0 111.726 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.9 mtpt -133.31 173.01 11.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.26 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -93.87 130.27 39.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.873 0.368 . . . . 0.0 111.255 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.5 mp -140.34 157.98 25.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.974 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.03 146.52 25.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.975 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.18 -129.95 10.11 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.519 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -126.16 89.32 3.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.728 0.299 . . . . 0.0 110.858 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.8 t -174.15 136.4 0.5 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.048 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.7 m -142.32 117.98 5.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.128 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.501 ' HA ' ' O ' ' A' ' 32' ' ' MET . 1.4 tttp -79.68 97.68 6.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.444 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.431 ' HB3' ' CB ' ' A' ' 12' ' ' ALA . 0.4 OUTLIER -97.7 145.36 26.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.363 179.277 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 14.2 ttt -72.86 99.32 2.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.922 0.392 . . . . 0.0 110.718 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -105.11 94.93 5.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.855 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 65.1 tttt 53.99 29.95 10.94 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.982 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 82.47 22.01 59.25 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.585 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -124.67 122.37 25.72 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-O 120.484 0.183 . . . . 0.0 110.753 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.61 127.53 23.97 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.416 2.077 . . . . 0.0 112.394 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.501 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 1.4 ptm -139.55 110.11 6.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.586 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.84 94.37 4.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.891 0.377 . . . . 0.0 111.51 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.798 ' HB2' ' HB2' ' A' ' 90' ' ' ALA . 2.2 m-85 -141.14 143.34 34.21 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.11 0.481 . . . . 0.0 110.133 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.414 ' HA ' ' O ' ' A' ' 90' ' ' ALA . 6.3 ttt180 -143.63 98.12 3.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.013 -0.54 . . . . 0.0 112.063 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.481 ' HB2' ' CB ' ' A' ' 89' ' ' LEU . 0.2 OUTLIER -142.72 88.68 2.08 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.318 178.91 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 pp -125.89 84.04 2.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.783 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -133.12 122.8 24.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.843 -179.743 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 10.4 p -138.67 141.88 36.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.025 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -100.51 128.47 46.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.869 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 90.7 m -103.68 93.95 5.66 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.919 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.64 158.29 53.86 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.471 2.114 . . . . 0.0 112.206 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -177.7 125.46 0.13 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.883 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.71 119.57 24.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.948 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.9 2.56 4.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.721 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.437 ' CG ' ' HD2' ' A' ' 47' ' ' PRO . 0.3 OUTLIER -121.33 145.8 43.23 Favored Pre-proline 0 C--N 1.332 -0.191 0 CA-C-O 120.605 0.24 . . . . 0.0 110.982 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.437 ' HD2' ' CG ' ' A' ' 46' ' ' HIS . 56.0 Cg_endo -69.97 127.92 15.1 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.541 2.161 . . . . 0.0 112.205 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.7 pttm -58.83 143.98 45.73 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.927 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -124.56 45.05 2.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.867 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -60.75 -162.5 0.14 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.522 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 11.6 p -78.84 117.78 25.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.717 0.294 . . . . 0.0 111.116 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -108.14 169.42 8.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.96 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.6 mtmm -84.56 93.44 8.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.918 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.438 ' HB3' ' CD1' ' A' ' 61' ' ' PHE . 12.3 m-85 -79.65 -33.6 41.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.965 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.527 ' N ' ' HB2' ' A' ' 61' ' ' PHE . . . -57.59 138.51 48.12 Favored Glycine 0 CA--C 1.508 -0.366 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.169 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.62 ' HD2' ' CB ' ' A' ' 60' ' ' ALA . 94.4 Cg_exo -38.29 -59.27 0.58 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 121.686 1.591 . . . . 0.0 112.843 -177.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -101.17 -78.05 0.53 Allowed 'General case' 0 C--N 1.348 0.508 0 C-N-CA 117.484 -1.686 . . . . 0.0 111.651 176.047 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -104.31 -74.74 0.64 Allowed 'General case' 0 C--N 1.346 0.415 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 176.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.546 ' O ' ' N ' ' A' ' 61' ' ' PHE . 89.4 p -100.59 -14.75 18.05 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 113.009 -1.905 . . . . 0.0 114.141 -178.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.62 ' CB ' ' HD2' ' A' ' 56' ' ' PRO . . . -37.0 -16.2 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -175.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.546 ' N ' ' O ' ' A' ' 59' ' ' SER . 5.6 t80 -52.63 -42.4 64.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 118.416 0.553 . . . . 0.0 111.379 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.418 ' HA ' ' HB2' ' A' ' 66' ' ' TRP . 32.9 p -82.38 -43.14 17.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.85 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.05 -20.12 15.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.507 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 44.8 mmtt -86.84 -63.73 1.26 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.768 0.318 . . . . 0.0 111.187 -179.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 2.8 ttp -89.27 -55.31 3.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.197 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . 0.45 ' CZ2' HG22 ' A' ' 72' ' ' ILE . 0.6 OUTLIER -51.4 -26.64 8.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.57 -179.738 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -94.06 -36.77 11.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.44 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -79.98 -28.15 39.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.347 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -108.3 150.97 26.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.094 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.31 92.96 9.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.009 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.435 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -160.35 98.86 1.29 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.923 179.936 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.45 HG22 ' CZ2' ' A' ' 66' ' ' TRP . 1.6 mp -136.05 130.96 49.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.963 0.411 . . . . 0.0 111.462 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -151.76 157.0 41.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.671 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -136.17 153.08 31.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.933 0.397 . . . . 0.0 111.194 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -163.55 78.66 0.42 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.701 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.439 ' CD2' ' O ' ' A' ' 89' ' ' LEU . 26.3 p90 -142.7 158.86 43.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.148 0.499 . . . . 0.0 111.523 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.23 162.76 4.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.411 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 67.3 mttt -50.55 -26.88 5.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.243 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.2 40.97 54.85 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.813 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -91.32 51.0 1.83 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.956 0.408 . . . . 0.0 110.799 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -122.68 -39.19 2.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.123 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.44 122.2 13.39 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.078 0.466 . . . . 0.0 111.047 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -115.46 -47.76 2.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.86 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.61 -61.06 2.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.113 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -80.97 -35.47 32.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.155 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.76 25.59 52.7 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.082 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.472 ' O ' ' O ' ' A' ' 88' ' ' GLY . 4.3 mtp85 -131.97 107.07 8.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.849 0.356 . . . . 0.0 110.645 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.472 ' O ' ' O ' ' A' ' 87' ' ' ARG . . . -54.29 -150.71 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.228 0 CA-C-N 115.736 -0.665 . . . . 0.0 113.125 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.481 ' CB ' ' HB2' ' A' ' 36' ' ' LEU . 0.5 OUTLIER -128.32 132.92 48.62 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 122.778 -0.248 . . . . 0.0 111.377 -179.223 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.798 ' HB2' ' HB2' ' A' ' 34' ' ' PHE . . . -128.76 154.84 45.98 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 120.35 -0.54 . . . . 0.0 112.134 178.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.468 ' CD1' ' O ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -117.8 127.12 53.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.81 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 8.6 pt -79.9 130.85 35.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.129 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -117.58 117.93 30.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.836 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.41 104.58 16.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.051 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.402 ' N ' ' HB2' ' A' ' 71' ' ' LYS . 0.4 OUTLIER 64.63 36.31 8.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.946 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 53.82 97.61 0.01 OUTLIER Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.625 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -91.09 102.27 15.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.826 0.346 . . . . 0.0 110.961 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.08 116.59 31.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.836 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 21.0 t 68.61 -68.0 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.173 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -131.18 -177.12 4.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.959 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -112.27 31.48 6.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.9 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -110.54 -167.88 1.24 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.201 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 11.0 tp 63.08 144.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.917 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.5 t 63.36 81.48 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.066 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.62 -44.88 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.903 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -114.44 32.75 5.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.842 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -166.12 -74.41 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.505 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.1 tp -64.43 -32.5 74.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.803 0.335 . . . . 0.0 110.824 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -63.66 97.37 0.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.99 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.315 -0.85 . . . . 0.0 110.893 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.81 0.338 . . . . 0.0 110.997 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.28 125.37 53.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.881 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.5 m -104.97 134.6 47.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.996 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 26.0 m -69.55 121.35 16.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.881 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.6 mtmm -72.67 146.49 46.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.994 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.72 149.27 47.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.74 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.5 mt -120.02 113.78 21.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.313 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 40.2 m-70 -71.59 99.9 2.17 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.38 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.7 mmtp -118.3 158.82 24.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.355 -179.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -104.22 164.68 14.81 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.232 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.451 ' HA ' ' CG ' ' A' ' 73' ' ' GLU . 86.6 Cg_endo -78.03 106.11 2.11 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.31 2.006 . . . . 0.0 112.857 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.578 ' O ' ' OG1' ' A' ' 13' ' ' THR . . . -158.19 124.5 4.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.389 179.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.692 ' HA ' ' HB3' ' A' ' 25' ' ' LEU . 76.1 m -176.31 24.88 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.888 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -98.09 83.81 3.17 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.013 -0.675 . . . . 0.0 110.06 178.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.423 ' HB ' ' CG ' ' A' ' 24' ' ' LYS . 2.1 mm -127.63 -70.88 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.395 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt -145.61 140.98 27.76 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.933 179.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.86 133.84 39.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.966 0.413 . . . . 0.0 111.622 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.468 HD13 HG23 ' A' ' 18' ' ' ILE . 16.5 mt -153.16 159.31 3.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.781 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.76 172.25 5.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.864 0.364 . . . . 0.0 111.042 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.448 ' CA ' ' HB2' ' A' ' 36' ' ' LEU . . . -69.73 65.85 0.63 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.835 -0.697 . . . . 0.0 112.472 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -148.18 -52.16 0.18 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.041 0.448 . . . . 0.0 110.143 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -143.19 106.48 4.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.818 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 23.2 t -130.78 128.09 62.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.324 179.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.423 ' CG ' ' HB ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -92.59 144.35 25.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.183 0.516 . . . . 0.0 111.944 -179.093 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.692 ' HB3' ' HA ' ' A' ' 13' ' ' THR . 0.0 OUTLIER -132.28 165.33 24.42 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.986 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 6.7 mtt -77.18 98.62 5.15 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -128.17 113.94 16.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.074 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 52.01 26.25 3.63 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.95 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.31 13.82 76.92 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.779 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -124.86 140.88 36.73 Favored Pre-proline 0 C--N 1.332 -0.16 0 CA-C-O 120.666 0.27 . . . . 0.0 111.024 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -68.16 135.78 35.56 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.481 2.12 . . . . 0.0 111.973 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.431 ' O ' HD11 ' A' ' 25' ' ' LEU . 2.5 mmt -145.11 110.46 5.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.244 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 61.9 p -77.02 131.04 38.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.16 0.505 . . . . 0.0 112.277 -179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.526 ' CD1' ' HB2' ' A' ' 89' ' ' LEU . 2.3 m-30 -106.57 158.73 16.71 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.976 179.461 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -115.64 148.08 40.07 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.348 179.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.526 ' HA ' ' HB3' ' A' ' 91' ' ' TYR . 0.1 OUTLIER -104.45 134.64 47.3 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.088 0.47 . . . . 0.0 111.682 -179.364 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.8 tp -144.25 133.74 23.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.618 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -96.58 148.56 22.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.812 0.339 . . . . 0.0 111.053 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.7 t -67.29 112.88 2.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.149 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -67.48 159.87 28.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.974 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.5 m -89.32 107.45 18.31 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.913 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -68.37 146.73 69.8 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.469 2.113 . . . . 0.0 112.326 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -130.85 173.84 10.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.823 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -78.92 100.78 7.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.834 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? 57.87 21.18 7.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.141 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -121.21 156.6 57.23 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.935 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.42 118.47 5.08 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.6 2.2 . . . . 0.0 112.236 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.2 pptp? -69.91 116.73 10.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.007 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -174.03 164.3 4.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.888 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -159.67 -163.48 13.44 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.416 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 29.7 m -71.2 140.13 18.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.694 0.283 . . . . 0.0 111.09 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.1 118.62 37.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.784 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -57.82 93.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.86 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -92.97 36.06 1.04 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.161 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -104.63 158.43 16.4 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.415 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.87 -15.64 36.78 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.571 2.181 . . . . 0.0 112.463 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.8 pm0 -55.87 -27.36 51.35 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.858 0.361 . . . . 0.0 111.217 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.31 -65.06 0.71 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.135 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.35 -38.54 89.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.832 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.51 -32.07 73.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.016 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.426 ' CD2' HG23 ' A' ' 99' ' ' VAL . 0.2 OUTLIER -59.34 -51.78 68.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.641 179.905 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 51.4 p -58.2 -45.54 87.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.783 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.9 tttm -54.92 -19.83 7.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.34 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.19 -63.38 1.31 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.935 0.398 . . . . 0.0 111.204 -179.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.5 ' O ' ' N ' ' A' ' 69' ' ' ALA . 2.1 mtt -87.93 -58.87 2.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.223 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . . . . . . . . . 74.9 t90 -51.55 -32.0 26.54 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -94.44 -52.66 4.23 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -179.168 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -79.47 -28.29 41.54 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.746 0.308 . . . . 0.0 111.625 -178.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 65' ' ' MET . . . -107.69 151.21 25.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.597 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.2 mtmt -103.41 97.25 7.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.844 0.354 . . . . 0.0 111.94 -178.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.443 ' HD3' ' CB ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -166.25 96.63 0.59 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.712 178.79 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.415 ' CB ' ' HB ' ' A' ' 13' ' ' THR . 1.3 mp -141.47 103.83 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.148 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.451 ' CG ' ' HA ' ' A' ' 11' ' ' PRO . 16.1 mt-10 -136.84 151.43 49.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.845 0.355 . . . . 0.0 111.796 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.471 HG12 ' CE2' ' A' ' 34' ' ' PHE . 2.0 m -103.81 153.63 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.793 -179.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.56 -75.41 0.61 Allowed 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.989 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -143.39 146.33 33.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.852 0.358 . . . . 0.0 111.007 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -59.12 148.29 31.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.093 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.404 ' NZ ' ' HB2' ' A' ' 80' ' ' GLN . 0.2 OUTLIER -101.2 -61.35 1.38 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.835 179.872 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 100.89 41.17 2.71 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.884 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.404 ' HB2' ' NZ ' ' A' ' 78' ' ' LYS . 2.8 mt-30 -123.97 150.77 44.41 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.855 0.36 . . . . 0.0 110.922 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 69.1 9.97 7.64 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.24 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.515 ' HB ' ' O ' ' A' ' 85' ' ' TYR . 0.5 OUTLIER -109.3 148.42 31.06 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.658 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -84.69 -52.57 5.98 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.073 0.463 . . . . 0.0 110.079 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.9 mttt -110.51 -57.29 2.24 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 177.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.737 ' O ' ' N ' ' A' ' 87' ' ' ARG . 65.9 m-85 -133.35 -37.7 0.95 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 113.879 -1.51 . . . . 0.0 107.985 176.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.419 ' CA ' ' HB ' ' A' ' 82' ' ' THR . . . 44.28 -36.71 0.0 OUTLIER Glycine 0 N--CA 1.472 1.086 0 C-N-CA 125.188 1.375 . . . . 0.0 115.662 177.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.737 ' N ' ' O ' ' A' ' 85' ' ' TYR . 0.1 OUTLIER -142.69 95.88 2.85 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 176.912 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -77.42 13.03 12.04 Favored Glycine 0 C--N 1.313 -0.75 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.179 179.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.526 ' HB2' ' CD1' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -128.2 149.81 50.29 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 122.787 0.435 . . . . 0.0 110.229 -179.17 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.449 ' O ' ' CD2' ' A' ' 34' ' ' PHE . . . -101.49 -178.31 3.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.023 0.44 . . . . 0.0 111.861 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.526 ' HB3' ' HA ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -71.97 145.69 48.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.834 -178.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.416 HG23 HG13 ' A' ' 74' ' ' VAL . 1.3 pp -96.55 160.31 2.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.99 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -110.91 119.13 38.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.013 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -97.44 93.74 6.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.082 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 12.3 t0 67.05 52.46 0.87 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.873 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 105.37 -81.99 0.33 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.598 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.71 135.99 53.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.821 0.343 . . . . 0.0 111.087 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.06 139.8 34.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.855 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.426 HG23 ' CD2' ' A' ' 61' ' ' PHE . 22.0 t -82.14 156.02 4.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.141 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -95.87 167.48 11.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.882 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -177.42 154.43 1.0 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.804 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -128.88 35.22 4.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.157 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 59.33 28.03 17.26 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.998 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 23.5 t 68.32 -67.66 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.273 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 3.9 ttt-85 62.16 33.24 16.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.002 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -173.56 80.88 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.902 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 155.32 -28.12 0.62 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.522 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 20.6 mt -108.72 -54.43 2.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.832 0.349 . . . . 0.0 110.861 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -108.78 -170.49 1.67 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.034 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.884 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.693 0.283 . . . . 0.0 111.024 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 66.5 p -108.86 103.14 12.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.827 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.7 t -105.44 106.81 17.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.949 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.1 p -110.37 135.14 51.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.961 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.93 144.59 54.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.869 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.7 mtpt -114.53 119.83 38.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.913 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.07 153.98 22.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.827 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -93.48 147.24 23.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.864 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.27 122.76 21.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.103 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -146.11 131.64 9.28 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.514 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.471 ' HA ' ' HA ' ' A' ' 73' ' ' GLU . 84.8 Cg_endo -79.75 171.13 16.0 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.293 1.995 . . . . 0.0 112.732 -179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -153.65 -136.18 0.06 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.717 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 3.5 t -162.24 178.44 8.73 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.743 0.306 . . . . 0.0 110.799 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.417 ' HB3' ' CZ2' ' A' ' 66' ' ' TRP . 0.0 OUTLIER -97.16 94.82 7.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.988 0.423 . . . . 0.0 111.076 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.9 mt -85.84 -68.63 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.007 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.4 ttpp -110.05 169.74 8.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.472 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -87.12 148.31 25.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.049 0.452 . . . . 0.0 111.85 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.414 ' CD1' ' HB ' ' A' ' 23' ' ' VAL . 5.9 tp -111.35 119.04 58.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.156 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -118.24 28.93 8.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.835 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.38 38.17 29.65 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.345 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -147.12 -49.47 0.19 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.747 0.308 . . . . 0.0 110.834 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 71.8 p -157.97 139.58 13.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.17 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.424 HG12 ' CD2' ' A' ' 91' ' ' TYR . 12.5 p -142.43 114.05 3.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.693 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.4 ptpt -91.02 125.98 35.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.386 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 21.6 mt -124.49 157.0 36.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.606 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.99 99.89 2.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.905 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -124.37 108.47 12.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.705 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 62.7 23.75 14.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.036 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 89.96 -14.14 62.73 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.92 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -110.66 144.82 31.03 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.838 0.319 . . . . 0.0 111.089 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -73.6 151.65 47.27 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.513 2.142 . . . . 0.0 112.199 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.445 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 1.7 mmm -145.15 113.77 6.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.093 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 37.2 p -89.81 86.68 6.72 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.411 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.445 ' CD1' ' HB3' ' A' ' 32' ' ' MET . 1.9 p90 -141.31 118.76 11.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.071 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.409 ' O ' ' HG2' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -139.89 120.27 13.98 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.347 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.522 ' HB3' ' HA ' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -143.11 146.51 33.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.12 178.201 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -144.17 135.08 25.21 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.935 0.398 . . . . 0.0 111.27 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.7 tt -59.3 96.94 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.772 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 5.2 m -126.91 122.07 59.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.182 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -135.45 130.36 34.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.852 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 34.5 m -106.26 121.92 43.87 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.859 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -56.15 137.0 78.06 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.489 2.126 . . . . 0.0 112.252 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 177.36 -169.42 0.07 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.608 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 30.6 p -60.91 140.16 57.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.433 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.54 -160.1 0.31 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -110.45 80.6 2.05 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 120.793 0.33 . . . . 0.0 111.186 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -84.3 155.6 12.62 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.732 2.288 . . . . 0.0 112.342 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 mttt -128.14 96.83 4.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.712 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -162.4 155.88 20.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.887 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -176.83 32.14 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.507 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.7 p -121.17 83.37 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.908 0.385 . . . . 0.0 110.997 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -96.37 139.78 32.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.849 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.62 90.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.836 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -130.74 26.07 5.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.189 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 75.03 -147.31 36.19 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.852 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.1 -2.67 12.63 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.86 2.374 . . . . 0.0 113.012 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -43.81 -30.65 0.69 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.84 0.352 . . . . 0.0 111.593 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.88 -60.9 2.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.966 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.6 p -62.07 -19.11 62.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.123 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -51.3 -29.06 13.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.771 0.32 . . . . 0.0 111.418 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -60.18 -63.87 1.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.809 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.426 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 0.6 OUTLIER -66.92 -34.79 78.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.749 -179.978 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 13.2 mttm -51.15 -19.85 1.31 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.627 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -81.02 -61.85 1.84 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.83 0.347 . . . . 0.0 111.013 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.443 ' O ' ' N ' ' A' ' 69' ' ' ALA . 5.7 mmt -88.68 -52.56 5.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.964 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . 0.426 ' HB3' ' O ' ' A' ' 62' ' ' THR . 68.2 t90 -53.66 -27.37 27.07 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.69 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -94.51 -56.42 2.81 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -79.88 -28.4 39.91 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 65' ' ' MET . . . -104.59 144.08 32.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.826 0.346 . . . . 0.0 110.866 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -96.59 92.6 6.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.153 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.453 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -162.06 98.11 1.05 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.015 179.536 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 2.7 mp -139.54 133.09 37.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.166 0.507 . . . . 0.0 111.96 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.576 ' HB2' ' CG ' ' A' ' 93' ' ' TYR . 10.3 mt-10 -146.7 170.09 17.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.353 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 27.2 m -108.14 131.99 57.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.977 0.417 . . . . 0.0 111.546 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -91.49 -164.33 1.16 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.845 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.3 p90 -92.89 136.39 33.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.056 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 36.6 p30 -103.94 162.0 13.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.044 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.0 ttmt -58.92 -66.45 0.5 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.946 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 91.23 27.72 17.35 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.588 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -129.0 -54.35 1.21 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.836 0.35 . . . . 0.0 110.984 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.87 97.9 9.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.83 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.52 ' HB ' ' HA2' ' A' ' 86' ' ' GLY . 1.6 p -83.49 171.04 13.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.726 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -115.23 -51.79 2.7 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 44.3 tttm -110.83 -64.34 1.29 Allowed 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -179.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -133.77 2.45 3.43 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.52 ' HA2' ' HB ' ' A' ' 82' ' ' THR . . . 128.15 51.01 0.14 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.307 -0.949 . . . . 0.0 112.601 -179.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 4.2 mtp85 -104.51 98.76 8.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.707 0.289 . . . . 0.0 110.991 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.442 ' O ' ' HB2' ' A' ' 34' ' ' PHE . . . -54.16 108.91 0.97 Allowed Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 178.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.21 96.47 4.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.423 0.63 . . . . 0.0 112.63 -177.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.522 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . . . -174.78 113.66 0.15 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.145 177.299 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.513 ' O ' ' CG ' ' A' ' 91' ' ' TYR . 0.0 OUTLIER -145.67 102.93 3.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.527 179.993 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 32.1 mm -150.04 107.7 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.181 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.576 ' CG ' ' HB2' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -153.24 135.43 14.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.036 178.848 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -134.42 99.75 4.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.875 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.441 ' CA ' ' HB2' ' A' ' 71' ' ' LYS . 4.4 t0 57.89 41.55 24.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.822 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.78 42.0 99.32 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.493 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.82 100.58 10.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.849 0.357 . . . . 0.0 110.881 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.72 145.6 24.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.847 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 11.2 p -60.45 -31.91 49.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.992 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -139.61 164.51 29.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.937 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -104.23 132.53 50.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.921 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -114.53 -57.95 2.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.099 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 3.1 pp -111.04 161.18 16.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.924 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 6.5 m -134.84 167.6 25.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.182 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 70.5 mtt85 -101.1 160.22 14.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.861 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -98.75 147.73 24.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.888 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.9 -79.51 1.84 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.455 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -69.46 -22.51 63.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.771 0.319 . . . . 0.0 111.086 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 70.37 -64.8 0.35 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.12 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.166 -0.921 . . . . 0.0 110.846 179.956 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.77 0.319 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -130.18 107.88 9.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.859 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.01 109.7 8.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.884 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.86 123.03 43.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.872 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.4 149.89 27.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.973 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt -72.96 118.16 15.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.898 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.99 157.09 35.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.902 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -89.12 142.06 27.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.765 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.4 mmmt -83.62 107.97 16.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.017 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -140.33 133.74 15.08 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.698 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -79.55 112.58 2.98 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.435 2.09 . . . . 0.0 112.636 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -166.07 104.6 0.66 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.026 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.641 ' HA ' ' HB3' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -174.14 9.0 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.253 -0.43 . . . . 0.0 112.063 179.816 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.416 HD12 ' CH2' ' A' ' 66' ' ' TRP . 11.7 tp -98.67 85.08 3.26 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 120.691 -0.403 . . . . 0.0 111.346 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.44 HD13 HG22 ' A' ' 15' ' ' ILE . 32.5 mt -126.8 -68.43 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.91 178.348 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.9 tptt -130.99 122.76 27.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.297 178.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.459 ' CB ' ' CZ3' ' A' ' 66' ' ' TRP . . . -76.91 120.86 22.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.086 0.47 . . . . 0.0 112.028 -178.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 25.0 mm -147.51 158.59 8.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.221 179.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.82 -176.16 0.63 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.534 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -66.84 70.22 0.18 Allowed Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.079 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -147.71 -51.98 0.19 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.912 0.386 . . . . 0.0 110.623 -179.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.444 ' HA ' ' O ' ' A' ' 34' ' ' PHE . 1.5 t -154.55 106.38 2.72 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.578 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.446 ' CG2' ' HB2' ' A' ' 34' ' ' PHE . 2.6 m -132.67 113.92 21.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.898 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.94 138.75 37.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.13 0.491 . . . . 0.0 112.011 -178.575 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.641 ' HB3' ' HA ' ' A' ' 13' ' ' THR . 0.1 OUTLIER -121.6 127.33 50.77 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.035 179.409 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -72.83 99.59 2.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.93 0.395 . . . . 0.0 110.886 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -117.38 114.4 23.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.806 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 59.91 28.15 17.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.812 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 82.66 18.98 64.67 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.72 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.34 128.07 21.03 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.656 0.228 . . . . 0.0 110.952 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -74.14 126.93 10.87 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.444 2.096 . . . . 0.0 112.227 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 18.5 mmt -119.17 110.73 17.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.167 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.3 m -70.98 157.13 38.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.334 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.482 ' CG ' ' CB ' ' A' ' 90' ' ' ALA . 1.9 m-85 -120.33 158.97 25.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.581 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -116.57 148.31 41.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.979 0.418 . . . . 0.0 111.082 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.2 tt -48.71 119.46 3.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.487 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.464 ' O ' ' O ' ' A' ' 38' ' ' LEU . 1.9 pp -49.06 165.23 0.06 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.912 179.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.464 ' O ' ' O ' ' A' ' 37' ' ' LEU . 23.0 tp -31.99 156.68 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.2 t -61.37 133.74 26.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.778 -179.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -137.04 165.7 25.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.307 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 92.3 m -76.26 112.06 18.86 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.962 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.416 ' CG ' ' HB3' ' A' ' 46' ' ' HIS . 97.5 Cg_endo -84.3 163.29 13.07 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.867 2.378 . . . . 0.0 112.524 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -130.51 -41.86 1.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.367 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 7.1 t -60.93 100.36 0.11 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.854 0.359 . . . . 0.0 111.218 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 44.92 20.86 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.334 179.575 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.416 ' HB3' ' CG ' ' A' ' 42' ' ' PRO . 2.5 m80 -121.88 127.68 25.89 Favored Pre-proline 0 C--N 1.33 -0.249 0 O-C-N 122.47 -0.144 . . . . 0.0 111.051 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -57.47 151.08 55.89 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.292 1.995 . . . . 0.0 112.148 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.75 166.11 5.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.909 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -117.49 -81.45 0.62 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.964 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -151.43 -46.79 0.02 OUTLIER Glycine 0 C--N 1.332 0.319 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.776 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 31.6 m -70.87 169.53 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.88 0.371 . . . . 0.0 111.246 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -108.12 168.36 9.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.865 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.2 mttp -60.08 91.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.857 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -131.63 20.16 4.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.182 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 172.58 59.84 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.679 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -78.22 -27.68 5.3 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.517 2.145 . . . . 0.0 112.397 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -65.04 -15.89 62.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.333 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -49.46 -33.49 14.37 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.835 0.35 . . . . 0.0 111.38 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -88.87 -24.1 22.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.042 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -76.16 -28.85 57.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.253 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -56.88 -48.01 79.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.939 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.434 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 1.3 t -64.63 -15.48 61.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.383 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.5 tttp -89.14 -66.47 0.92 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.414 ' O ' ' N ' ' A' ' 68' ' ' ASN . 8.8 mttt -88.79 -64.34 1.16 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.978 0.418 . . . . 0.0 111.998 -178.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.91 -21.53 3.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.745 -179.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . 0.459 ' CZ3' ' CB ' ' A' ' 17' ' ' ALA . 22.9 t90 -99.2 -37.34 9.33 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -179.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -94.11 -49.02 5.95 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -178.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.414 ' N ' ' O ' ' A' ' 64' ' ' LYS . 91.3 m-20 -79.72 -28.37 40.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.663 0.268 . . . . 0.0 111.565 -179.171 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -108.15 151.05 26.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.747 0.308 . . . . 0.0 111.092 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.2 mmtt -96.35 96.01 8.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.27 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.699 ' HB2' ' N ' ' A' ' 95' ' ' ASP . 0.0 OUTLIER -166.14 100.52 0.63 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.648 179.577 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.51 HG22 HD13 ' A' ' 72' ' ' ILE . 0.0 OUTLIER -139.23 105.27 2.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.471 -179.659 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -128.73 169.7 14.19 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.249 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.1 t -115.18 147.4 18.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.852 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.425 ' HB2' ' CE2' ' A' ' 93' ' ' TYR . 4.8 tt0 -110.78 -69.95 0.84 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.696 0.284 . . . . 0.0 111.613 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -110.04 118.16 35.67 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.896 0.379 . . . . 0.0 111.371 -179.318 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -104.2 91.83 4.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.464 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -61.18 -83.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.043 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 91.86 -29.0 7.79 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.712 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -110.69 -38.35 5.18 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.785 0.326 . . . . 0.0 110.893 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.4 ttt-85 -75.99 63.39 1.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.81 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.402 ' CG2' ' HA2' ' A' ' 86' ' ' GLY . 10.4 p -87.7 151.09 23.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.712 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -114.97 -51.9 2.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.25 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.79 -64.03 1.32 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.866 0.365 . . . . 0.0 111.286 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -133.79 12.39 4.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.447 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.402 ' HA2' ' CG2' ' A' ' 82' ' ' THR . . . 128.08 0.75 6.41 Favored Glycine 0 CA--C 1.519 0.342 0 C-N-CA 120.518 -0.849 . . . . 0.0 112.963 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -107.77 98.98 8.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.953 0.406 . . . . 0.0 110.978 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -117.32 -85.47 1.11 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.274 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.2 tp -102.28 101.01 11.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.721 0.296 . . . . 0.0 110.676 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.482 ' CB ' ' CG ' ' A' ' 34' ' ' PHE . . . -152.24 137.75 17.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.923 0.392 . . . . 0.0 111.506 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -142.15 122.23 13.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.635 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.423 HG22 ' CD2' ' A' ' 34' ' ' PHE . 2.7 pt -89.49 149.9 3.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.832 0.349 . . . . 0.0 111.275 -179.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.486 ' CD1' ' HA2' ' A' ' 96' ' ' GLY . 0.0 OUTLIER -137.77 168.09 20.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.081 179.466 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -94.08 99.73 11.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.715 -179.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.699 ' N ' ' HB2' ' A' ' 71' ' ' LYS . 1.9 t0 76.6 21.0 1.34 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.125 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.486 ' HA2' ' CD1' ' A' ' 93' ' ' TYR . . . 45.27 53.87 7.6 Favored Glycine 0 CA--C 1.517 0.184 0 C-N-CA 121.035 -0.602 . . . . 0.0 112.912 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.88 99.79 12.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.878 0.37 . . . . 0.0 110.93 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.87 137.22 32.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.803 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.8 m -104.26 92.68 2.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.11 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 12.1 p-10 -168.87 -41.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.934 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 62.25 108.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.902 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -129.12 -73.54 0.57 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.02 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 5.1 mp 58.98 106.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.942 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.5 t -96.44 -66.68 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.114 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.02 -49.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.857 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.51 -46.02 0.98 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.842 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 140.22 44.31 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.532 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.7 mp -137.95 -52.61 0.63 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.86 0.362 . . . . 0.0 110.896 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 59.46 85.14 0.1 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.131 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.9 mmtt . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.895 -179.95 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.786 0.326 . . . . 0.0 111.042 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.4 m -111.88 95.78 5.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.913 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 30.3 t -101.85 114.92 29.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.87 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.2 p -105.35 117.82 34.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.822 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.28 113.09 25.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.918 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.2 mtpt -116.53 140.59 49.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.897 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.96 151.19 22.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.942 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -120.56 88.92 3.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.675 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.72 158.18 29.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.01 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -104.76 158.6 31.67 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.714 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -78.87 157.31 27.42 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.426 2.084 . . . . 0.0 112.535 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -120.29 -90.25 0.58 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.318 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 175.67 164.24 0.33 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.89 0.376 . . . . 0.0 110.875 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.452 ' CB ' ' CZ2' ' A' ' 66' ' ' TRP . 1.7 pp -90.12 139.88 30.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.827 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.4 HD11 HG21 ' A' ' 15' ' ' ILE . 3.4 mt -125.08 -77.1 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.392 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.9 mtpt -145.2 137.99 26.21 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.88 0.372 . . . . 0.0 110.961 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -126.35 106.3 9.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.984 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -51.28 -77.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.311 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -118.16 -80.97 0.62 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.739 0.304 . . . . 0.0 110.841 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -174.71 33.5 0.1 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.528 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -122.08 -35.53 3.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.69 0.281 . . . . 0.0 111.039 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 t -147.03 139.58 24.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.808 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 29.4 t -142.79 129.58 18.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.277 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.421 ' HA ' ' O ' ' A' ' 32' ' ' MET . 0.0 OUTLIER -79.65 143.68 34.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.203 -179.76 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.428 HD23 ' CZ ' ' A' ' 91' ' ' TYR . 0.4 OUTLIER -136.52 165.01 26.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.645 179.797 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 23.3 mmt -84.98 99.85 11.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.858 0.361 . . . . 0.0 110.87 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -115.63 95.7 5.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.868 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.6 mmtm 58.32 30.18 19.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.956 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 91.33 -14.07 64.73 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.629 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -99.31 141.42 22.81 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 120.694 0.283 . . . . 0.0 110.871 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.54 134.71 15.59 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.514 2.142 . . . . 0.0 112.249 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.459 ' HB3' ' CE1' ' A' ' 34' ' ' PHE . 3.5 mmt -129.19 110.54 12.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.926 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.72 86.75 4.15 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.918 -179.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.498 ' CD1' ' N ' ' A' ' 34' ' ' PHE . 0.5 OUTLIER -137.78 107.11 6.1 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.779 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 tpt180 -140.38 127.72 21.22 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.458 ' CB ' ' HA ' ' A' ' 90' ' ' ALA . 6.9 tp -143.12 111.06 5.99 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.349 178.354 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -143.99 149.69 37.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.076 0.465 . . . . 0.0 111.603 -179.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -151.13 96.91 2.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.36 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.443 ' CG2' ' CD2' ' A' ' 61' ' ' PHE . 26.9 m -97.24 121.42 47.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.547 -179.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -137.14 96.19 3.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.796 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -156.83 120.06 2.24 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.179 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -57.52 163.24 8.94 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.467 2.111 . . . . 0.0 112.305 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -106.78 3.82 26.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.469 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.0 t -111.06 119.01 37.6 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.697 0.284 . . . . 0.0 110.916 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.17 -148.38 0.45 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.221 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.439 ' O ' ' CD2' ' A' ' 46' ' ' HIS . 0.3 OUTLIER -70.25 116.88 49.16 Favored Pre-proline 0 C--O 1.232 0.149 0 O-C-N 122.31 -0.243 . . . . 0.0 110.651 -179.877 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.13 105.87 0.91 Allowed 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.428 2.085 . . . . 0.0 112.645 -179.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.43 96.71 4.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.589 179.443 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 50.57 96.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.958 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -123.46 -105.28 1.72 Allowed Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.735 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 27.7 m -70.9 147.09 11.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.729 0.299 . . . . 0.0 111.203 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -100.41 179.03 4.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.828 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -81.36 90.98 6.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.93 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -87.81 -32.48 19.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.824 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 130.42 -81.66 0.33 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.469 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -52.43 -28.72 36.69 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.602 2.201 . . . . 0.0 112.325 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -67.44 -36.12 80.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.854 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.82 -32.77 65.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.102 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.7 t -60.08 -31.36 69.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.884 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -85.81 -29.98 23.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.199 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.443 ' CD2' ' CG2' ' A' ' 39' ' ' VAL . 1.5 t80 -60.25 -47.18 87.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.915 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 14.8 p -58.09 -50.08 74.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.82 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -21.63 9.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.107 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.3 tttm -88.44 -59.37 2.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.833 0.349 . . . . 0.0 110.961 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.427 ' O ' ' N ' ' A' ' 69' ' ' ALA . 5.8 mtt -90.27 -56.35 3.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.489 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . 0.452 ' CZ2' ' CB ' ' A' ' 14' ' ' LEU . 28.4 t90 -53.94 -24.75 17.49 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.71 0.263 . . . . 0.0 111.71 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.32 -48.32 6.21 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.567 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.93 -28.2 39.75 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.427 ' N ' ' O ' ' A' ' 65' ' ' MET . . . -105.02 151.23 24.21 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.785 0.326 . . . . 0.0 110.814 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.1 mmtt -95.37 92.95 6.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.878 -179.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.568 ' HB2' ' O ' ' A' ' 93' ' ' TYR . 0.0 OUTLIER -142.77 96.97 3.02 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.845 178.692 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -141.58 103.07 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.076 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.551 ' CB ' ' HB2' ' A' ' 93' ' ' TYR . 0.0 OUTLIER -166.81 178.65 5.75 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.664 -0.414 . . . . 0.0 111.263 177.862 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.425 ' HB ' ' CE1' ' A' ' 91' ' ' TYR . 11.7 p -123.45 153.02 28.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.889 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -99.52 -118.38 0.15 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.588 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 54.8 p90 -107.07 134.15 50.63 Favored 'General case' 0 N--CA 1.457 -0.085 0 CA-C-O 120.798 0.332 . . . . 0.0 111.039 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.7 p-10 -78.7 117.95 20.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.942 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.25 -34.0 19.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.996 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 57.64 28.78 60.37 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.492 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -91.97 -64.05 1.16 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.718 0.294 . . . . 0.0 110.9 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -54.81 42.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.826 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 11.9 t -70.72 120.86 16.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.622 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -115.38 -51.27 2.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.971 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.7 pttm -101.41 -29.34 12.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.898 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.14 -35.65 76.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.54 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 67.7 24.19 74.04 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.684 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.426 ' HA ' ' CE2' ' A' ' 34' ' ' PHE . 0.6 OUTLIER -121.32 97.95 5.75 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.26 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -61.71 115.88 8.57 Favored Glycine 0 N--CA 1.452 -0.296 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 178.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.404 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.5 mt -77.25 97.3 4.79 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.151 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.458 ' HA ' ' CB ' ' A' ' 36' ' ' LEU . . . -174.17 114.24 0.19 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.116 177.722 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.485 ' CD1' ' HB2' ' A' ' 34' ' ' PHE . 0.3 OUTLIER -145.21 94.35 2.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.476 179.156 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 6.6 pt -150.17 108.86 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 C-N-CA 120.409 -0.516 . . . . 0.0 111.953 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.568 ' O ' ' HB2' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -151.65 168.78 23.91 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.387 179.294 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -122.07 106.48 11.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.833 0.349 . . . . 0.0 111.233 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.4 t0 52.07 26.21 3.66 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.835 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 77.8 13.88 82.97 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.57 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.5 mtpm? -136.96 149.22 47.42 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.735 0.302 . . . . 0.0 110.873 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 1.3 ttt -82.71 110.37 17.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.925 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 31.4 t 59.5 62.28 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.102 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 57.11 -168.17 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.064 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -97.98 -46.47 5.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.05 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -106.2 139.21 41.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.077 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -123.82 -68.42 0.87 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.988 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.2 t 58.99 103.92 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.08 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 22.8 ptt180 -152.14 -43.86 0.11 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.928 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -168.35 35.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.976 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -115.84 -129.98 4.59 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.422 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.9 mp -76.69 -21.1 55.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.63 0.253 . . . . 0.0 110.953 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 66.49 98.14 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.889 0.376 . . . . 0.0 111.075 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.186 -0.911 . . . . 0.0 110.851 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.854 0.359 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 18.2 p -125.68 138.02 53.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.868 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -111.99 143.78 42.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.943 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.9 p -111.95 154.07 25.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.948 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -55.1 148.05 14.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.109 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -115.28 106.8 14.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.858 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.7 pp -69.96 156.9 38.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.146 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 12.9 t60 -90.49 159.1 16.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.704 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.52 120.41 42.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.915 0.388 . . . . 0.0 111.356 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -137.83 129.02 15.98 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.336 179.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.724 ' HA ' ' HA ' ' A' ' 73' ' ' GLU . 87.7 Cg_endo -82.76 158.84 16.24 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.42 2.08 . . . . 0.0 112.939 -179.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -115.84 -129.87 0.3 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.56 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 175.99 -86.74 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.218 0 O-C-N 122.269 -0.27 . . . . 0.0 111.698 179.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.37 112.39 23.97 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.852 0.358 . . . . 0.0 111.234 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.47 ' CD1' HG12 ' A' ' 72' ' ' ILE . 2.6 mp -125.47 160.21 31.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.241 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.19 122.8 47.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.374 179.439 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.29 123.61 50.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.447 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.458 ' CG1' ' N ' ' A' ' 19' ' ' ASP . 0.5 OUTLIER -117.87 -89.43 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.812 179.755 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.458 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 1.0 OUTLIER -118.32 28.84 8.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.716 0.294 . . . . 0.0 110.977 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 61.32 57.42 18.34 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.233 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -147.19 -44.26 0.17 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.805 0.336 . . . . 0.0 110.795 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 54.6 p -132.51 106.87 8.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.182 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.413 HG21 ' CE1' ' A' ' 34' ' ' PHE . 27.5 m -128.76 113.71 30.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.52 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.6 ptmt -90.35 105.54 17.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.681 -179.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.432 HD21 ' CE2' ' A' ' 91' ' ' TYR . 1.7 pt? -108.1 165.05 11.77 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.347 179.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 2.7 ttm -77.37 99.85 5.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.857 0.361 . . . . 0.0 111.047 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -115.0 100.33 8.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.744 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 61.16 31.04 19.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.896 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.39 24.28 66.04 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.549 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -142.1 120.89 7.74 Favored Pre-proline 0 C--N 1.33 -0.257 0 O-C-N 122.769 -0.254 . . . . 0.0 110.981 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -59.72 132.41 45.3 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.353 2.035 . . . . 0.0 112.002 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 11.7 mtp -134.49 118.06 16.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.978 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -95.59 127.21 41.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.102 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.413 ' CE1' HG21 ' A' ' 23' ' ' VAL . 35.2 p90 -141.03 158.18 44.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.985 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -92.74 148.14 22.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.774 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.7 pp -48.98 153.95 0.81 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.297 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.96 155.05 39.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.093 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.02 131.58 55.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.818 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.8 m -84.86 137.83 20.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.195 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -95.12 123.41 38.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.905 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 71.5 m -88.35 139.44 30.16 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.826 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -67.19 148.75 81.2 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.471 2.114 . . . . 0.0 112.169 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -69.64 -28.59 66.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.027 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.7 m -75.06 147.68 40.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.105 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 4.0 mtpm? 63.14 -80.17 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.208 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.416 ' CG ' ' HD2' ' A' ' 47' ' ' PRO . 1.8 t-80 -91.39 148.4 37.51 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.944 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.416 ' HD2' ' CG ' ' A' ' 46' ' ' HIS . 48.5 Cg_exo -55.71 153.44 30.12 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.528 2.152 . . . . 0.0 112.236 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.4 tttp -92.74 107.78 19.48 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.805 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.72 130.37 4.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.853 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.99 86.19 0.38 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.447 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 27.5 m -71.05 161.56 4.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.726 0.298 . . . . 0.0 111.138 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -108.01 151.69 25.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.848 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 6.5 mtpm? -59.68 95.88 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.898 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.4 p90 -96.75 27.6 3.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.03 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -113.98 166.68 12.17 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.589 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.43 -18.9 29.3 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.656 2.237 . . . . 0.0 112.569 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -52.53 -25.71 11.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.32 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.03 -60.77 3.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.412 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 94.8 p -92.93 -16.04 25.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.538 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -83.84 -61.76 1.74 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.716 0.293 . . . . 0.0 111.451 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -54.78 -53.87 49.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.259 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.518 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 36.9 p -59.7 -21.05 60.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.233 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.5 tttt -89.11 -19.48 25.49 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.334 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp -88.59 -64.18 1.18 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.857 -179.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -89.14 -54.31 4.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.685 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . 0.518 ' HB3' ' O ' ' A' ' 62' ' ' THR . 37.8 t90 -58.75 -18.55 32.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.713 -179.281 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.81 -44.6 9.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.826 0.346 . . . . 0.0 111.192 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -79.99 -28.04 39.56 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.184 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.407 ' CB ' ' HE3' ' A' ' 71' ' ' LYS . . . -108.04 151.21 26.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.86 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.2 ptpt -100.83 92.6 5.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.407 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.407 ' HE3' ' CB ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -138.26 98.03 3.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.052 179.423 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.47 HG12 ' CD1' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -139.86 119.88 13.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.771 0.319 . . . . 0.0 111.596 -179.545 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.724 ' HA ' ' HA ' ' A' ' 11' ' ' PRO . 10.4 mt-10 -149.25 172.11 15.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.479 179.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.426 ' HA ' ' HB2' ' A' ' 91' ' ' TYR . 34.9 t -100.85 141.57 17.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.4 -179.296 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -135.14 -2.86 2.5 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.464 ' CD1' ' HB3' ' A' ' 91' ' ' TYR . 0.0 OUTLIER -92.68 164.32 13.43 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.884 0.373 . . . . 0.0 111.573 -179.634 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -100.85 139.19 36.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.911 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.0 pttp -68.77 108.44 3.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.954 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 88.08 41.11 6.35 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.481 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.12 -63.69 1.36 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.785 0.326 . . . . 0.0 110.816 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -162.12 94.82 0.93 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.007 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.444 ' HB ' ' HA2' ' A' ' 86' ' ' GLY . 7.6 p -74.37 154.31 38.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.769 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -115.23 -51.8 2.7 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.293 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.6 tptt -110.74 -64.0 1.33 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.788 0.328 . . . . 0.0 111.612 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.415 ' O ' ' CG ' ' A' ' 85' ' ' TYR . 81.9 t80 -133.9 11.15 3.96 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.623 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.444 ' HA2' ' HB ' ' A' ' 82' ' ' THR . . . 128.09 -15.33 6.18 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.573 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -90.3 98.76 11.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.781 0.324 . . . . 0.0 110.929 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -147.11 -44.54 0.03 OUTLIER Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.438 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -81.5 148.36 29.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.897 0.38 . . . . 0.0 110.904 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.416 ' O ' ' HB3' ' A' ' 76' ' ' PHE . . . -102.67 142.56 33.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.206 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.464 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . 1.8 p90 -141.04 88.01 2.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.012 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -150.2 141.2 16.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.081 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.442 ' CD1' ' HG3' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -123.36 117.99 26.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.619 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -111.43 91.87 3.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.051 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 58.2 23.81 10.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.065 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -74.56 -100.96 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.551 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? -107.7 109.83 21.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.903 0.382 . . . . 0.0 110.887 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 7.9 mtp -78.43 131.09 36.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.885 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 9.7 m -74.67 128.07 36.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.113 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -71.8 82.6 0.89 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.908 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -135.82 142.86 44.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.83 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -82.05 -67.74 0.76 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.119 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -149.79 -78.29 0.14 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.899 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.4 t 57.2 90.07 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.214 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -137.44 -58.53 0.69 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.877 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -116.22 -41.44 3.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.857 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -173.47 -97.46 0.11 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.435 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -130.94 31.92 4.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.773 0.32 . . . . 0.0 110.854 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -125.4 148.74 48.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.082 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.285 -0.865 . . . . 0.0 110.8 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.698 0.285 . . . . 0.0 111.023 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.02 107.98 18.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.908 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 63.8 p -107.22 110.19 22.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.959 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 40.9 p -76.75 123.86 26.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.824 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.19 108.63 19.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.918 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 tppm? -104.13 100.97 10.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.81 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.416 ' CD1' ' HG2' ' A' ' 9' ' ' LYS . 0.7 OUTLIER -96.2 146.62 24.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.92 -179.883 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -114.03 109.77 18.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.912 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.416 ' HG2' ' CD1' ' A' ' 7' ' ' LEU . 1.0 OUTLIER -122.04 159.09 27.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.154 -179.852 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -104.09 164.27 15.66 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.627 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.427 ' CA ' ' HG3' ' A' ' 73' ' ' GLU . 91.0 Cg_endo -78.48 150.07 24.7 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.596 2.197 . . . . 0.0 112.692 -179.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -121.34 -81.86 0.64 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.194 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 171.36 131.25 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.725 0.298 . . . . 0.0 111.001 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -98.19 130.29 44.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.994 179.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.451 HG13 ' H ' ' A' ' 16' ' ' LYS . 0.8 OUTLIER -84.46 -51.52 13.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.231 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.451 ' H ' HG13 ' A' ' 15' ' ' ILE . 14.2 tttm -164.46 151.26 11.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.518 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -125.43 148.05 48.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.406 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.457 HD13 HG21 ' A' ' 18' ' ' ILE . 31.9 pt -123.82 -167.0 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.914 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -71.19 62.7 0.33 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.796 0.332 . . . . 0.0 111.431 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.41 ' HA3' ' CD2' ' A' ' 36' ' ' LEU . . . 44.33 77.22 0.1 OUTLIER Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.989 -0.625 . . . . 0.0 113.095 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -147.64 -46.26 0.17 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.98 0.419 . . . . 0.0 110.796 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -167.99 106.93 0.52 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.873 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 32.6 m -121.35 113.85 41.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.672 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.66 147.4 25.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.358 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.419 HD21 ' CD2' ' A' ' 34' ' ' PHE . 0.1 OUTLIER -137.99 137.21 37.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.176 179.622 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 3.1 tpt -72.75 99.43 2.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.923 0.392 . . . . 0.0 110.863 -179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -118.78 116.22 26.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.702 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 25.4 mmtm 58.86 28.09 17.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.89 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.12 25.5 66.28 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.553 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -142.07 113.07 6.28 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 120.453 0.168 . . . . 0.0 110.901 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.83 141.0 95.9 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.477 2.118 . . . . 0.0 112.271 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.426 ' HB3' ' CZ ' ' A' ' 34' ' ' PHE . 0.6 OUTLIER -142.2 110.92 6.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.979 -179.848 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.422 ' O ' ' CD1' ' A' ' 34' ' ' PHE . 1.4 t -78.28 139.9 38.86 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.196 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.52 ' CD1' ' CD2' ' A' ' 91' ' ' TYR . 26.0 m-85 -141.39 138.51 33.04 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.194 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -101.11 148.07 25.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.641 179.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.41 ' CD2' ' HA3' ' A' ' 20' ' ' GLY . 0.3 OUTLIER -56.57 169.3 0.48 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.34 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -95.73 163.06 13.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.932 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.41 96.88 7.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.772 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 14.3 p -108.6 121.45 61.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.168 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -122.71 145.14 48.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.846 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.8 t -102.04 116.23 63.5 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.924 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -67.59 161.28 44.24 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.436 2.091 . . . . 0.0 112.173 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.58 -82.54 0.05 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.82 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -111.14 100.95 9.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.94 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -177.9 -78.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.92 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -112.73 163.84 16.9 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.946 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -53.04 148.81 29.11 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.556 2.171 . . . . 0.0 112.299 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -78.64 142.41 37.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.963 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 2.7 pttp -168.25 -43.5 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.943 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -60.85 169.84 8.5 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.539 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 11.3 p -102.95 159.31 4.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.79 0.329 . . . . 0.0 111.059 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -92.85 149.97 20.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.808 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.91 90.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.894 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -112.59 -33.91 5.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.915 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 136.27 -147.97 19.46 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.445 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -69.2 -9.97 27.74 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.584 2.189 . . . . 0.0 112.6 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.81 -29.69 55.25 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.746 0.308 . . . . 0.0 110.997 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.24 -31.01 68.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.046 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 t -71.59 -24.12 61.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.063 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -55.5 -23.24 24.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.371 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -53.38 -52.06 60.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.085 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.405 ' O ' ' N ' ' A' ' 66' ' ' TRP . 1.3 p -60.98 -47.86 84.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.966 0.412 . . . . 0.0 110.914 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.2 mtmt -55.7 -20.03 12.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.358 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.4 tptt -84.98 -59.8 2.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.722 0.296 . . . . 0.0 111.37 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 14.0 mtt -90.01 -49.9 6.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.313 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . 0.439 ' CE2' HG21 ' A' ' 72' ' ' ILE . 10.0 t-105 -54.79 -34.72 63.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.303 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -94.49 -52.13 4.46 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -79.79 -28.38 40.3 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.353 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.42 ' CB ' ' HD3' ' A' ' 71' ' ' LYS . . . -107.22 151.16 25.8 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.839 0.352 . . . . 0.0 111.224 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.4 tttt -89.69 92.99 9.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.568 -179.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.493 ' HB2' ' CA ' ' A' ' 94' ' ' ALA . 0.0 OUTLIER -166.22 98.33 0.61 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.556 179.096 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.439 HG21 ' CE2' ' A' ' 66' ' ' TRP . 4.8 pt -139.9 128.79 27.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.0 0.428 . . . . 0.0 111.828 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.427 ' HG3' ' CA ' ' A' ' 11' ' ' PRO . 0.2 OUTLIER -162.42 171.02 17.81 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.032 179.605 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.428 HG11 ' CD1' ' A' ' 91' ' ' TYR . 0.4 OUTLIER -111.28 152.99 13.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.809 179.699 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -93.51 -79.66 0.4 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.521 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.42 ' O ' ' CE1' ' A' ' 91' ' ' TYR . 7.0 p90 -129.73 141.44 50.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.807 0.337 . . . . 0.0 111.324 -179.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -104.05 110.38 22.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.748 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.6 tttt -58.83 -35.23 72.57 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.903 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 106.16 28.04 5.38 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.431 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -106.97 161.7 14.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.79 0.329 . . . . 0.0 110.839 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.77 45.15 2.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.883 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 1.8 p -95.88 126.49 41.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.945 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -115.12 -50.85 2.74 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.948 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -104.64 -21.67 13.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.139 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -55.45 -30.64 60.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.235 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 125.19 51.35 0.18 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.535 -0.841 . . . . 0.0 112.554 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 1.7 ttt85 -58.75 112.85 1.78 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.883 0.373 . . . . 0.0 110.959 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -105.32 22.07 33.72 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.779 -0.725 . . . . 0.0 112.561 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.417 ' HB3' ' CE2' ' A' ' 91' ' ' TYR . 38.2 mt -78.06 148.02 34.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.715 0.293 . . . . 0.0 110.695 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -105.95 134.29 49.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.033 0.444 . . . . 0.0 111.502 -179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.52 ' CD2' ' CD1' ' A' ' 34' ' ' PHE . 96.9 m-85 -142.12 90.22 2.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.456 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 25.3 mm -133.82 116.89 24.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.983 0.421 . . . . 0.0 111.818 -179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -151.13 117.78 5.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.326 179.219 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.493 ' CA ' ' HB2' ' A' ' 71' ' ' LYS . . . -94.38 113.36 25.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.679 -179.349 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.488 ' N ' ' HB2' ' A' ' 71' ' ' LYS . 16.3 t70 49.97 25.91 1.82 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.985 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.14 102.69 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.237 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.3 mtpt -87.03 99.74 12.12 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.987 0.422 . . . . 0.0 110.781 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -82.16 141.74 32.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.786 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 12.0 p -104.19 -30.82 2.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.045 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -127.51 -72.16 0.64 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.998 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -176.8 -177.46 0.79 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.936 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -109.83 157.7 18.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.181 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 5.5 mt -93.57 -175.06 3.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.869 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 30.9 m -56.25 155.59 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.22 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.25 -62.19 1.56 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.929 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -158.4 32.48 0.24 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.029 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 139.36 -100.13 0.28 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.6 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.477 ' CD1' ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -118.5 73.81 0.93 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.843 0.354 . . . . 0.0 110.98 -179.877 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -57.82 -42.1 83.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.141 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 5.7 mtmt . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.131 -0.938 . . . . 0.0 111.002 179.883 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.778 0.323 . . . . 0.0 111.041 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 55.5 p -102.65 99.27 9.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.863 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.9 p -87.39 134.68 33.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.924 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.11 109.41 1.83 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.917 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -79.96 113.22 17.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.908 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.19 143.8 32.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.811 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.97 141.17 34.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.865 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -93.63 159.07 15.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.846 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.4 mttp -75.86 107.9 8.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.021 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -139.13 143.54 37.11 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.521 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.461 ' HA ' ' HA ' ' A' ' 73' ' ' GLU . 84.2 Cg_endo -83.75 164.37 13.98 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.476 2.117 . . . . 0.0 112.711 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -119.29 104.69 10.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.999 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 44.7 p -64.69 80.94 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.273 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tt -69.7 120.96 16.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.431 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 26.4 mt -125.27 -69.86 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.7 pttt -121.68 145.95 47.5 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.925 0.393 . . . . 0.0 111.435 -179.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -124.08 147.52 47.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.868 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.48 HG22 HD13 ' A' ' 18' ' ' ILE . 42.6 mm -96.81 -88.92 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.346 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -118.25 107.32 13.77 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.8 0.333 . . . . 0.0 111.045 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 98.67 -113.99 4.89 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.447 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -123.25 16.39 9.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.599 0.237 . . . . 0.0 111.159 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.6 t -74.85 106.78 6.55 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.893 0.378 . . . . 0.0 110.725 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.8 t -128.77 134.67 63.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.966 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.73 97.86 6.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.707 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.38 142.53 30.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.867 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.76 100.0 3.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.915 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -96.73 100.42 11.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.873 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.9 tttm 56.31 31.35 18.43 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.988 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 90.54 20.92 39.12 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.823 -0.704 . . . . 0.0 112.576 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.89 112.5 6.88 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.572 0.225 . . . . 0.0 110.778 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.2 129.49 21.8 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.351 2.034 . . . . 0.0 112.358 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.412 ' HB3' ' CZ ' ' A' ' 34' ' ' PHE . 33.6 mmm -145.04 118.7 9.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.933 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.409 ' O ' ' CD1' ' A' ' 34' ' ' PHE . 0.8 OUTLIER -70.38 135.34 48.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.077 -179.966 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.424 ' HB3' ' CB ' ' A' ' 90' ' ' ALA . 27.0 m-85 -140.69 152.75 45.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.907 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtt-85 -117.3 148.0 42.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.972 0.415 . . . . 0.0 111.081 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 35.0 tp -78.06 138.39 38.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.786 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.421 ' HB2' ' CE1' ' A' ' 91' ' ' TYR . 8.5 tt -82.83 94.34 7.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.804 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -124.88 163.33 22.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.909 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.3 m -61.95 159.92 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.241 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -128.28 132.08 48.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.614 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.7 t -76.93 111.34 15.7 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.064 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -67.93 163.04 37.17 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.541 2.16 . . . . 0.0 112.191 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -98.27 37.87 1.4 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.802 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 69.0 p -103.71 103.84 13.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.041 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.2 mtpm? 62.04 -82.8 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.081 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -120.94 146.64 44.38 Favored Pre-proline 0 C--N 1.332 -0.185 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.07 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -74.43 125.89 9.95 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.619 2.212 . . . . 0.0 112.219 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.8 tttp -124.91 112.97 17.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.996 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 61.57 118.05 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.924 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 158.65 127.4 0.92 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.505 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 28.8 t -110.23 106.11 20.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.847 0.356 . . . . 0.0 110.973 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -92.94 179.3 5.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.974 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.53 90.97 0.05 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.793 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -89.66 -32.89 16.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.955 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 155.42 -152.34 23.84 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.667 -0.777 . . . . 0.0 112.603 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -59.9 -16.41 38.22 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.745 2.297 . . . . 0.0 112.699 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -46.55 -29.19 1.68 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.429 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -77.46 -53.47 7.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.18 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.7 p -69.52 -24.54 63.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.238 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -54.72 -23.51 18.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.613 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.408 ' CE2' ' HE2' ' A' ' 65' ' ' MET . 16.1 m-85 -55.1 -31.11 60.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.815 0.34 . . . . 0.0 111.198 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 13.0 t -79.07 -17.48 55.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.279 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 67' ' ' GLU . 0.5 OUTLIER -89.41 -57.28 2.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.847 0.356 . . . . 0.0 111.441 -179.73 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.0 mtmp? -88.65 -59.18 2.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.205 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.462 ' HA ' ' CB ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -55.67 -20.36 13.86 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.664 -179.347 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . 0.447 ' CE2' ' CG ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -99.22 -33.71 10.65 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.359 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.421 ' HB2' ' O ' ' A' ' 63' ' ' LYS . 5.2 mt-10 -94.0 -56.32 2.91 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 -179.534 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -80.17 -28.87 38.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.892 0.377 . . . . 0.0 110.991 -179.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.462 ' CB ' ' HA ' ' A' ' 65' ' ' MET . . . -108.78 152.6 24.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.698 179.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.48 163.74 0.4 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.46 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.447 ' CG ' ' CE2' ' A' ' 66' ' ' TRP . 0.1 OUTLIER -84.9 162.06 19.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.108 0.48 . . . . 0.0 111.486 -178.622 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 1.1 pp -102.83 145.22 12.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.849 -179.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.461 ' HA ' ' HA ' ' A' ' 11' ' ' PRO . 44.5 mt-10 -127.89 179.1 5.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.634 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.6 p -112.34 140.97 29.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.907 0.384 . . . . 0.0 111.055 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -106.88 -66.89 0.98 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.02 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 35.8 p90 -143.0 129.35 19.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.947 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.53 157.84 15.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.993 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -49.56 77.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.811 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 64.0 32.28 83.65 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.591 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -101.57 9.39 41.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.614 0.245 . . . . 0.0 111.315 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 26.4 mtm180 54.57 95.43 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.714 0.292 . . . . 0.0 111.175 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 41.7 m -62.2 148.98 42.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.908 0.385 . . . . 0.0 110.664 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -115.29 -40.18 3.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.287 -179.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.41 -63.11 1.02 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.245 -179.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -127.36 -35.15 2.21 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.15 -179.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 109.56 49.8 0.73 Allowed Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.728 -0.749 . . . . 0.0 111.845 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.402 ' HB2' ' CZ ' ' A' ' 87' ' ' ARG . 2.5 mtm105 -131.92 101.77 5.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.782 0.325 . . . . 0.0 111.022 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -48.83 171.44 0.07 OUTLIER Glycine 0 CA--C 1.518 0.26 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.415 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.4 mp -111.19 112.66 24.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.84 0.352 . . . . 0.0 111.192 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.424 ' CB ' ' HB3' ' A' ' 34' ' ' PHE . . . -128.62 130.08 46.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.798 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.421 ' CE1' ' HB2' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -98.85 149.82 22.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.066 -179.762 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 2.7 pp -79.88 160.12 4.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.056 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -140.85 168.23 20.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.947 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.84 112.52 24.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.996 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.9 p30 45.21 41.93 6.46 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.412 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 104.69 -60.01 0.43 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.657 -0.783 . . . . 0.0 112.673 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.08 142.67 51.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.862 0.363 . . . . 0.0 110.966 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -60.09 140.37 56.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.026 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 5.4 t -80.34 163.1 3.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.959 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 29.1 p30 -47.27 164.18 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.181 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -57.73 136.91 56.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.998 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 62.05 115.89 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.264 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.4 tt -132.45 -66.78 0.68 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.899 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 13.0 m -144.66 30.9 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.028 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.06 -172.81 3.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.852 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 6.8 pm0 -109.89 29.05 7.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.074 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 136.45 63.09 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.739 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.404 ' N ' ' CD2' ' A' ' 108' ' ' LEU . 3.3 mm? 54.62 86.9 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.876 0.369 . . . . 0.0 111.173 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 63.29 -80.81 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.178 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.132 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.829 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.422 0 CA-C-O 120.717 0.294 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.4 t -107.19 95.31 5.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.805 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.8 m -74.45 128.84 36.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.958 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 76.9 p -68.18 104.01 1.7 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.904 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.72 157.03 21.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.897 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -69.01 137.48 53.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.956 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.4 120.26 21.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.005 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . 0.414 ' CE1' ' OH ' ' A' ' 27' ' ' TYR . 12.8 p-80 -70.99 157.19 38.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.703 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.6 mmtp -94.98 112.65 24.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.423 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.0 113.75 32.67 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.246 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.465 ' HA ' ' O ' ' A' ' 72' ' ' ILE . 83.1 Cg_endo -86.65 109.31 0.85 Allowed 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.513 2.142 . . . . 0.0 113.223 -178.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -166.42 -78.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.556 179.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.509 ' HA ' ' HB2' ' A' ' 25' ' ' LEU . 30.1 p 41.88 28.74 0.1 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 179.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -98.16 85.55 3.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.857 0.36 . . . . 0.0 110.563 179.411 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 10.5 mm -126.29 -69.81 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.88 179.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -141.85 173.04 11.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.304 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -122.35 140.0 53.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.034 0.445 . . . . 0.0 111.554 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 7.8 tt -173.6 164.23 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.768 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.42 171.97 5.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.784 0.326 . . . . 0.0 110.872 -179.656 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -60.86 82.98 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.617 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -147.27 -49.66 0.18 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.083 0.468 . . . . 0.0 110.47 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 t -172.06 106.58 0.2 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.515 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.473 ' O ' ' HA ' ' A' ' 33' ' ' THR . 35.9 m -122.52 127.59 75.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.122 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.465 ' HA ' ' HA ' ' A' ' 33' ' ' THR . 0.2 OUTLIER -79.21 133.99 36.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.864 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.509 ' HB2' ' HA ' ' A' ' 13' ' ' THR . 0.5 OUTLIER -126.29 148.08 49.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.632 179.975 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.74 101.81 3.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.054 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.414 ' OH ' ' CE1' ' A' ' 8' ' ' HIS . 3.0 t80 -119.81 120.53 36.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.745 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.3 pttt 49.09 28.11 1.98 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.341 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.65 10.36 85.91 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.82 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.4 ' HA ' ' HD3' ' A' ' 31' ' ' PRO . 1.7 mm-40 -121.97 142.46 36.44 Favored Pre-proline 0 CA--C 1.53 0.197 0 CA-C-N 116.726 0.263 . . . . 0.0 110.888 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 30' ' ' GLN . 35.0 Cg_exo -59.87 127.56 23.83 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.493 2.129 . . . . 0.0 112.264 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.486 ' HB3' ' CE1' ' A' ' 34' ' ' PHE . 25.6 mmt -145.21 110.75 5.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.782 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.473 ' HA ' ' O ' ' A' ' 23' ' ' VAL . 1.6 t -101.41 86.93 3.08 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.878 0.37 . . . . 0.0 111.829 -179.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.667 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -113.48 107.65 16.11 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.961 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.794 ' HA ' ' O ' ' A' ' 90' ' ' ALA . 16.5 tpt180 -143.88 95.01 2.66 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.202 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.468 ' CB ' ' HB3' ' A' ' 89' ' ' LEU . 0.1 OUTLIER -145.39 88.42 1.86 Allowed 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.386 178.551 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.2 pp -110.02 126.35 53.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.003 0.43 . . . . 0.0 110.754 179.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -44.33 122.78 3.16 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.641 -179.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.5 m -141.98 109.81 2.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.849 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -125.32 95.73 4.57 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.046 -179.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.16 147.32 59.1 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.886 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -51.64 131.34 37.02 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.606 2.204 . . . . 0.0 112.36 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -141.06 -174.3 3.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.868 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 50.7 p -78.19 151.09 33.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.863 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.9 mmtt 65.7 -78.43 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.838 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 10.2 m170 -72.8 112.6 15.88 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.928 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.78 120.97 6.03 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.376 2.051 . . . . 0.0 112.377 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.9 160.62 31.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.85 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -170.98 44.06 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.925 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -84.34 -72.96 1.27 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.447 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 9.9 m -75.87 170.09 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.736 0.303 . . . . 0.0 111.134 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -91.7 154.91 18.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.818 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.86 90.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.836 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -102.34 -31.5 10.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.94 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 77.43 -139.67 23.45 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.534 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -68.96 -10.23 28.58 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.571 2.181 . . . . 0.0 112.527 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -54.9 -34.47 63.12 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.796 0.332 . . . . 0.0 111.035 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.55 -49.93 75.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.106 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.7 t -77.73 -16.02 58.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.406 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -50.89 -29.52 12.17 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.827 0.346 . . . . 0.0 111.5 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -57.48 -34.82 69.43 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.867 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.522 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 29.3 p -91.17 -15.29 29.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.215 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.436 ' O ' ' HB2' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -89.69 -56.96 3.04 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -179.264 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.8 tmtt? -89.18 -64.57 1.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.427 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 0.5 OUTLIER -59.43 -20.47 55.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.464 -178.311 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' TRP . . . . . 0.522 ' HB3' ' O ' ' A' ' 62' ' ' THR . 23.9 t90 -99.39 -33.83 10.54 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -179.067 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.436 ' HB2' ' O ' ' A' ' 63' ' ' LYS . 9.7 mm-40 -94.12 -53.57 3.91 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 -179.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -79.75 -28.32 40.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.654 0.264 . . . . 0.0 111.578 -178.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.428 ' HB1' ' HD3' ' A' ' 71' ' ' LYS . . . -108.23 151.29 26.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.813 0.339 . . . . 0.0 111.23 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.1 mtmp? -97.94 94.83 7.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.274 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.478 ' HB2' ' N ' ' A' ' 95' ' ' ASP . 0.0 OUTLIER -164.45 98.95 0.81 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.502 179.567 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.465 ' O ' ' HA ' ' A' ' 11' ' ' PRO . 0.0 OUTLIER -133.48 127.48 53.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.12 179.864 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -162.87 158.26 22.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.735 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.3 m -133.54 152.52 35.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.145 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -157.54 93.55 1.3 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.864 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.492 ' CE2' ' CD2' ' A' ' 34' ' ' PHE . 42.0 p90 -143.13 118.11 10.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.155 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -91.91 91.9 8.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.606 179.683 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.412 ' CD ' HD13 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -94.52 -68.83 0.78 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.126 -179.719 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 64.13 27.31 71.27 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.352 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -129.18 116.05 18.61 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.977 0.418 . . . . 0.0 110.8 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.36 102.04 0.16 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.916 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.41 ' HB ' ' HA2' ' A' ' 86' ' ' GLY . 26.7 m -58.77 149.12 27.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.44 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -115.74 -48.78 2.75 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -178.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.33 -63.17 0.58 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.309 -0.405 . . . . 0.0 112.049 -178.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -133.31 -35.33 1.03 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.788 0.328 . . . . 0.0 111.25 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.41 ' HA2' ' HB ' ' A' ' 82' ' ' THR . . . 120.55 34.61 0.92 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.816 -179.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -138.89 120.38 15.02 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.104 0.478 . . . . 0.0 110.945 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -75.01 -140.16 0.7 Allowed Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 115.791 -0.64 . . . . 0.0 112.759 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.468 ' HB3' ' CB ' ' A' ' 36' ' ' LEU . 3.4 mp -128.46 116.01 19.05 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 122.109 0.163 . . . . 0.0 111.134 -179.409 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.794 ' O ' ' HA ' ' A' ' 35' ' ' ARG . . . -136.33 161.98 34.3 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 178.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.497 ' CD1' ' N ' ' A' ' 91' ' ' TYR . 0.0 OUTLIER -132.07 158.07 42.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.403 -178.874 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 2.4 pp -79.94 148.16 6.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.342 -179.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -140.17 129.69 24.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.878 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.416 ' HA ' ' HB2' ' A' ' 71' ' ' LYS . . . -83.98 110.23 18.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.378 -179.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.478 ' N ' ' HB2' ' A' ' 71' ' ' LYS . 1.5 t70 60.72 20.22 10.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.685 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 64.66 122.92 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.518 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.7 tptm -93.58 107.06 18.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.759 0.314 . . . . 0.0 110.849 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.07 149.29 29.28 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.989 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 18.0 m -142.99 69.9 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.094 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -99.19 161.75 13.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.902 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -129.06 30.95 4.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.948 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -125.29 83.18 2.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.155 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 5.9 mp -102.83 125.73 49.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.889 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 28.5 m -80.91 124.87 39.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.09 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.87 24.83 2.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.043 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 57.91 105.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.995 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 105.54 -132.66 11.22 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.501 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.71 74.9 0.18 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.834 0.349 . . . . 0.0 110.916 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -120.09 121.18 38.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.033 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.128 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.921 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.86 0.362 . . . . 0.0 110.669 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.519 HD21 ' H ' ' A' ' 77' ' ' ASP . 1.5 pp -87.8 120.34 29.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.115 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -81.39 88.8 6.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.515 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.548 ' HE2' HG21 ' A' ' 74' ' ' VAL . 1.8 tttt -88.11 159.45 18.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.409 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.16 165.39 13.69 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.202 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.497 ' HB3' ' CG ' ' A' ' 73' ' ' GLU . 93.2 Cg_endo -77.55 163.14 29.81 Favored 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.347 2.031 . . . . 0.0 112.289 -178.735 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.663 ' HB3' HD23 ' A' ' 25' ' ' LEU . . . -115.56 -165.38 1.03 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.13 0.491 . . . . 0.0 111.716 -179.148 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.5 p -116.36 -174.89 2.64 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.06 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.515 HD22 ' O ' ' A' ' 62' ' ' THR . 61.1 tp -98.34 113.86 25.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.814 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 22.4 mm -125.18 -43.88 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.914 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.909 ' O ' HG13 ' A' ' 23' ' ' VAL . 6.3 tttt -142.12 141.54 32.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.716 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -127.01 119.32 26.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.153 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.931 HD12 HG23 ' A' ' 22' ' ' THR . 23.7 mt -150.61 152.88 11.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.096 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -68.6 76.8 0.29 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.893 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 48.51 74.05 0.29 Allowed Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.529 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.412 ' HB2' HG21 ' A' ' 18' ' ' ILE . 71.9 m-20 -147.8 -48.7 0.17 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.129 0.49 . . . . 0.0 110.575 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.931 HG23 HD12 ' A' ' 18' ' ' ILE . 1.3 t -169.87 106.57 0.35 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.676 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.909 HG13 ' O ' ' A' ' 16' ' ' LYS . 41.5 t -127.24 113.42 32.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.526 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.38 127.47 32.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.264 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.663 HD23 ' HB3' ' A' ' 12' ' ' ALA . 7.1 mp -114.6 139.06 49.92 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.334 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.86 99.39 2.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.914 0.388 . . . . 0.0 110.793 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -116.36 115.39 25.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.751 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.3 ttmp? 63.84 25.23 13.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.013 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 93.88 -13.97 66.29 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.642 -0.789 . . . . 0.0 112.884 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -112.3 139.45 22.55 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.835 0.318 . . . . 0.0 111.011 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -79.21 139.02 14.61 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.684 2.256 . . . . 0.0 112.419 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.485 ' HB3' ' CZ ' ' A' ' 34' ' ' PHE . 3.1 mmt -139.34 128.22 23.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.935 0.397 . . . . 0.0 111.029 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.485 HG21 ' OG1' ' A' ' 22' ' ' THR . 86.7 m -79.31 127.8 32.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.905 -179.425 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.989 ' CB ' ' HB3' ' A' ' 90' ' ' ALA . 38.0 m-85 -141.33 130.92 23.98 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.45 179.083 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -143.33 96.26 2.89 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.754 HD21 ' OD2' ' A' ' 83' ' ' ASP . 0.2 OUTLIER -144.34 87.29 1.87 Allowed 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.364 177.497 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.617 ' O ' HD23 ' A' ' 38' ' ' LEU . 0.6 OUTLIER -145.71 103.9 3.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.931 0.396 . . . . 0.0 111.267 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.617 HD23 ' O ' ' A' ' 37' ' ' LEU . 55.9 mt . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.006 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.428 ' HA ' ' CD2' ' A' ' 61' ' ' PHE . . . . . . . . 0 N--CA 1.462 0.142 0 CA-C-O 120.84 0.352 . . . . 0.0 111.412 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.2 p -54.0 -22.14 9.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.545 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -86.02 -31.2 22.13 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.861 0.362 . . . . 0.0 110.768 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.491 ' CA ' ' HB2' ' A' ' 65' ' ' MET . 19.0 m-30 -55.56 -30.59 61.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.743 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.583 ' HA ' ' HB2' ' A' ' 66' ' ' TRP . 0.0 OUTLIER -63.68 -14.79 55.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.549 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.7 mtpt -90.94 -68.36 0.8 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.139 0.495 . . . . 0.0 111.418 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.1 mttt -87.96 -51.49 5.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.084 -179.479 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.603 ' O ' ' HB3' ' A' ' 69' ' ' ALA . 2.1 mmt -63.63 -13.98 47.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.568 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' TRP . . . . . 0.583 ' HB2' ' HA ' ' A' ' 62' ' ' THR . 18.8 t90 -83.56 -34.96 25.09 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 121.392 0.615 . . . . 0.0 109.668 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -94.34 -22.99 17.99 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.118 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -114.1 -28.15 7.42 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.653 ' HB1' ' CB ' ' A' ' 95' ' ' ASP . . . -108.22 154.66 21.44 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.39 -178.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.505 ' O ' ' N ' ' A' ' 96' ' ' GLY . 0.0 OUTLIER -51.24 100.45 0.03 OUTLIER 'General case' 0 C--O 1.225 -0.188 0 CA-C-O 122.059 0.933 . . . . 0.0 108.676 -179.828 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.575 ' HB3' ' HA ' ' A' ' 66' ' ' TRP . 0.0 OUTLIER -84.97 174.41 9.79 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.312 -1.313 . . . . 0.0 114.019 -176.377 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.826 HG21 HG23 ' A' ' 92' ' ' ILE . 23.1 pt -63.96 141.05 18.69 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.21 0 CA-C-O 122.278 1.037 . . . . 0.0 113.757 -175.446 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.497 ' CG ' ' HB3' ' A' ' 11' ' ' PRO . 41.2 mt-10 -158.78 157.57 31.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 113.371 -1.741 . . . . 0.0 107.927 179.46 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.548 HG21 ' HE2' ' A' ' 9' ' ' LYS . 1.7 p -100.85 145.12 11.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.359 -0.536 . . . . 0.0 111.073 -179.257 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.412 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -125.79 -69.25 0.79 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.534 -179.197 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.412 ' CD1' ' HB3' ' A' ' 75' ' ' GLU . 12.6 p90 -138.67 156.4 47.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.947 0.403 . . . . 0.0 111.236 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.519 ' H ' HD21 ' A' ' 7' ' ' LEU . 6.3 m-20 -104.03 158.47 16.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.823 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.9 tptt -87.42 -40.72 14.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.044 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 106.02 26.46 6.04 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.573 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -118.56 -40.47 2.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.907 0.384 . . . . 0.0 110.701 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.749 ' HA ' HD22 ' A' ' 89' ' ' LEU . 0.0 OUTLIER 80.04 -54.76 0.38 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.191 179.848 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.551 HG22 ' HG3' ' A' ' 81' ' ' ARG . 1.3 t -110.04 120.61 43.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.651 0.262 . . . . 0.0 111.078 179.555 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.754 ' OD2' HD21 ' A' ' 36' ' ' LEU . 0.2 OUTLIER -115.54 -51.58 2.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.261 179.893 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.34 -63.22 1.41 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.195 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -103.51 -35.2 8.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.898 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLY . . . . . 0.483 ' HA2' ' CB ' ' A' ' 82' ' ' THR . . . 108.61 51.09 0.72 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.005 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 61.5 mtt-85 -130.43 97.85 4.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.909 0.385 . . . . 0.0 111.208 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.425 ' HA3' ' O ' ' A' ' 33' ' ' THR . . . 53.01 168.38 0.02 OUTLIER Glycine 0 C--N 1.331 0.255 0 CA-C-N 115.919 -0.582 . . . . 0.0 113.136 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.749 HD22 ' HA ' ' A' ' 81' ' ' ARG . 1.0 OUTLIER -128.74 97.93 4.83 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.542 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.989 ' HB3' ' CB ' ' A' ' 34' ' ' PHE . . . -165.46 148.0 7.75 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.064 0.459 . . . . 0.0 111.659 178.178 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.662 ' N ' ' CD1' ' A' ' 91' ' ' TYR . 0.1 OUTLIER -92.5 136.96 32.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.906 -177.665 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.848 HD11 ' O ' ' A' ' 34' ' ' PHE . 2.5 mp -89.52 109.62 20.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.318 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.626 ' N ' HG22 ' A' ' 72' ' ' ILE . 3.5 m-85 -88.41 117.49 27.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.86 0.362 . . . . 0.0 110.613 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -113.47 121.26 43.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.914 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.653 ' CB ' ' HB1' ' A' ' 69' ' ' ALA . 4.6 p-10 44.78 44.56 7.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.078 0.466 . . . . 0.0 110.838 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 70' ' ' LYS . . . . . . . . 0 CA--C 1.52 0.365 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.931 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.118 0 CA-C-O 120.818 0.342 . . . . 0.0 111.014 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.95 HD21 ' CG ' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -84.06 151.08 25.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.72 -179.997 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' HIS . . . . . 0.718 ' H ' HD13 ' A' ' 7' ' ' LEU . 7.3 m80 -117.81 136.56 53.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.934 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -116.94 116.25 27.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.953 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.431 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 0.4 OUTLIER -155.14 145.48 15.95 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.159 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.549 ' HB3' HG21 ' A' ' 72' ' ' ILE . 73.7 Cg_endo -78.44 141.1 17.62 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.14 1.893 . . . . 0.0 112.526 -179.533 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.839 ' O ' HD11 ' A' ' 72' ' ' ILE . . . -115.32 -165.42 1.03 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.031 -179.827 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.442 HG22 ' H ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -120.03 -168.86 1.68 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.976 0.417 . . . . 0.0 111.276 -179.501 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.442 ' H ' HG22 ' A' ' 13' ' ' THR . 0.9 OUTLIER -53.86 157.27 2.45 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.417 -179.746 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.462 ' CG2' ' HB3' ' A' ' 25' ' ' LEU . 1.2 pp -112.03 -179.12 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.089 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.76 172.97 6.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.837 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.761 ' O ' HD13 ' A' ' 18' ' ' ILE . . . -106.47 126.81 52.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.116 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.761 HD13 ' O ' ' A' ' 17' ' ' ALA . 19.7 mm -141.41 158.17 21.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.214 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.471 ' N ' HG22 ' A' ' 18' ' ' ILE . 12.9 p-10 -72.96 66.42 0.79 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.81 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 160.88 -130.55 2.39 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.361 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.525 ' O ' HG13 ' A' ' 23' ' ' VAL . 52.0 m-20 -113.09 -15.26 12.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.696 0.284 . . . . 0.0 110.887 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.548 ' OG1' HG21 ' A' ' 18' ' ' ILE . 31.1 p -54.6 109.08 0.45 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.97 0.414 . . . . 0.0 111.424 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.617 ' O ' HD23 ' A' ' 25' ' ' LEU . 35.3 m -122.73 118.89 56.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.619 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.86 106.49 16.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.492 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.663 HD11 ' CD ' ' A' ' 75' ' ' GLU . 0.3 OUTLIER -118.76 164.95 14.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.593 179.513 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 2.4 ttp -79.95 99.8 7.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.567 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.425 ' CD1' ' HB2' ' A' ' 28' ' ' LYS . 51.1 t80 -124.27 133.43 53.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.998 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.425 ' HB2' ' CD1' ' A' ' 27' ' ' TYR . 0.0 OUTLIER 57.37 28.68 15.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.93 179.988 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.54 4.91 85.48 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.941 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -136.78 143.9 44.61 Favored Pre-proline 0 C--N 1.332 -0.163 0 CA-C-N 116.737 0.269 . . . . 0.0 111.008 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.39 130.12 14.68 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.523 2.148 . . . . 0.0 112.28 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.441 ' HB2' ' CE2' ' A' ' 34' ' ' PHE . 8.3 mtt -139.67 134.24 31.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.004 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.54 129.3 35.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.834 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.774 ' CB ' ' HB2' ' A' ' 90' ' ' ALA . 60.8 m-85 -138.73 158.23 44.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.972 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.562 ' C ' ' HB3' ' A' ' 90' ' ' ALA . 16.0 ptt180 -102.43 120.86 41.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.763 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.897 HD12 HG23 ' A' ' 92' ' ' ILE . 3.3 mm? -44.57 151.52 0.27 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.239 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.471 ' O ' HD23 ' A' ' 38' ' ' LEU . 3.9 pp -59.52 138.24 57.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.029 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.471 HD23 ' O ' ' A' ' 37' ' ' LEU . 27.4 mt . . . . . 0 C--N 1.328 -0.359 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.803 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.087 0 CA-C-O 120.902 0.382 . . . . 0.0 111.024 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.2 p -63.5 -28.61 70.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.956 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -55.13 -26.15 36.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.312 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -57.17 -31.53 65.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.076 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.485 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 44.6 p -87.11 -21.77 25.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.11 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.484 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 5.0 mtmt -89.18 -19.99 24.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.206 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.76 -64.26 1.17 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.779 -179.293 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 9.9 mmm -89.16 -52.97 4.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.8 -178.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' TRP . . . . . 0.485 ' HB3' ' O ' ' A' ' 62' ' ' THR . 83.5 t90 -62.11 -15.54 46.11 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.263 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.484 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 22.4 tt0 -89.57 -51.97 5.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.799 0.333 . . . . 0.0 111.15 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -80.02 -28.15 39.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.146 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -108.07 150.91 26.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.837 0.351 . . . . 0.0 111.186 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.8 mtpt -98.28 96.46 8.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.828 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.23 125.11 22.62 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.207 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.839 HD11 ' O ' ' A' ' 12' ' ' ALA . 0.3 OUTLIER -88.01 154.1 3.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.264 179.263 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -134.28 151.36 51.23 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.431 ' HB ' ' O ' ' A' ' 10' ' ' GLU . 7.5 p -126.47 153.22 34.86 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.7 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.663 ' CD ' HD11 ' A' ' 25' ' ' LEU . 2.5 mp0 -100.98 166.86 10.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.904 0.383 . . . . 0.0 111.166 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.95 ' CG ' HD21 ' A' ' 7' ' ' LEU . 6.3 m-30 -93.0 168.1 11.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.875 -179.782 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -96.89 91.91 5.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.715 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.706 ' HG3' HD12 ' A' ' 89' ' ' LEU . 0.1 OUTLIER -77.85 -28.14 50.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.96 -179.877 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 68.21 25.17 74.68 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.38 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.06 84.49 2.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.876 0.369 . . . . 0.0 110.587 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 61.0 ttt180 -50.95 100.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.07 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.703 HG21 ' C ' ' A' ' 87' ' ' ARG . 7.4 p -58.79 120.9 9.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.596 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -115.31 -45.44 2.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.374 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.09 -50.33 11.11 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.198 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -133.0 -35.04 1.07 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.233 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 97.73 46.87 2.21 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.815 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.703 ' C ' HG21 ' A' ' 82' ' ' THR . 21.9 mtm180 -133.47 99.16 4.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.837 0.351 . . . . 0.0 111.307 -179.44 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -85.07 -121.46 1.03 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.371 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.706 HD12 ' HG3' ' A' ' 78' ' ' LYS . 6.2 mt -128.18 128.19 44.32 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.843 0.354 . . . . 0.0 110.965 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.774 ' HB2' ' CB ' ' A' ' 34' ' ' PHE . . . -111.56 148.67 32.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.263 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.51 ' CZ ' ' CG ' ' A' ' 76' ' ' PHE . 1.6 m-85 -137.07 158.28 44.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.339 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.897 HG23 HD12 ' A' ' 36' ' ' LEU . 2.0 pp -124.85 111.75 29.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.862 0.363 . . . . 0.0 111.623 -179.721 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -98.71 134.44 41.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.602 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.47 110.84 22.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.286 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.2 t0 47.82 30.47 1.91 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.168 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.396 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.352 -179.926 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.069 0 CA-C-O 120.845 0.355 . . . . 0.0 111.069 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.458 HD22 ' O ' ' A' ' 75' ' ' GLU . 2.9 pp -73.1 157.0 38.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.958 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 5.2 m170 -80.07 124.81 29.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.711 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 ptpt -101.09 107.73 19.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.939 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -155.14 120.84 2.62 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.796 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.414 ' N ' ' HG2' ' A' ' 73' ' ' GLU . 84.2 Cg_endo -78.72 146.81 21.4 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.299 1.999 . . . . 0.0 112.124 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.814 ' HB1' ' O ' ' A' ' 26' ' ' MET . . . -127.83 -86.78 0.57 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.347 -179.842 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.657 HG23 ' O ' ' A' ' 12' ' ' ALA . 0.1 OUTLIER 167.57 119.77 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.678 0.275 . . . . 0.0 110.991 -179.908 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.725 ' HA ' HD12 ' A' ' 25' ' ' LEU . 10.9 tp -85.8 155.84 20.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.202 179.233 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.768 HD11 ' HG3' ' A' ' 26' ' ' MET . 12.7 mt -125.2 -72.34 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.34 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -120.23 146.51 45.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.893 0.377 . . . . 0.0 111.289 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.865 ' HA ' HG12 ' A' ' 23' ' ' VAL . . . -127.1 97.94 5.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.941 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.593 HD11 ' CB ' ' A' ' 21' ' ' ASP . 5.7 pt -64.62 -164.23 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.108 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -69.14 63.4 0.13 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.644 0.259 . . . . 0.0 111.499 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 42.58 70.21 0.52 Allowed Glycine 0 CA--C 1.519 0.289 0 C-N-CA 121.23 -0.51 . . . . 0.0 113.295 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.593 ' CB ' HD11 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -147.09 -39.57 0.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.592 0.234 . . . . 0.0 111.128 179.818 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.7 t -169.5 120.74 0.7 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.867 0.365 . . . . 0.0 111.144 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.865 HG12 ' HA ' ' A' ' 17' ' ' ALA . 33.6 m -117.66 131.73 69.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.885 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.403 ' HB3' ' HB ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -79.13 147.35 32.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.924 0.392 . . . . 0.0 111.209 -179.572 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.725 HD12 ' HA ' ' A' ' 14' ' ' LEU . 2.1 tp -141.01 125.37 17.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.82 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.814 ' O ' ' HB1' ' A' ' 12' ' ' ALA . 7.7 mtt -72.92 99.82 2.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.821 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -125.67 126.94 45.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.965 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.53 33.23 20.65 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.085 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.21 20.67 73.35 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.457 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.412 ' HA ' ' HD3' ' A' ' 31' ' ' PRO . 8.3 mt-30 -134.66 119.71 14.08 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.542 0.21 . . . . 0.0 110.84 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 30' ' ' GLN . 34.1 Cg_exo -59.72 133.52 51.77 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.401 2.067 . . . . 0.0 112.431 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.608 ' HB3' ' CE2' ' A' ' 34' ' ' PHE . 15.2 mmt -132.33 110.16 10.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.155 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.602 HG23 ' O ' ' A' ' 33' ' ' THR . 8.8 t -120.69 86.3 2.55 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -179.125 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.608 ' CE2' ' HB3' ' A' ' 32' ' ' MET . 1.7 p90 -142.09 106.26 4.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.438 177.896 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.641 ' HG3' ' HB1' ' A' ' 90' ' ' ALA . 13.4 ttp180 -140.55 97.08 3.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.634 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.926 HD11 ' HA2' ' A' ' 88' ' ' GLY . 0.5 OUTLIER -142.54 88.78 2.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.894 0.378 . . . . 0.0 110.75 178.971 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.732 ' C ' HD13 ' A' ' 38' ' ' LEU . 0.9 OUTLIER -133.03 93.73 3.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.794 180.0 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.732 HD13 ' C ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.841 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.101 0 CA-C-O 120.836 0.35 . . . . 0.0 111.249 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.3 m -62.35 -30.8 71.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.089 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.62 -30.47 71.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.232 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 35.3 t80 -71.97 -42.07 66.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.041 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.432 ' CA ' ' HB3' ' A' ' 66' ' ' TRP . 81.1 p -76.11 -48.82 19.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.928 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.473 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -53.8 -21.33 7.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.442 -179.949 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.51 -60.86 1.85 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.301 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.491 ' O ' ' HB3' ' A' ' 69' ' ' ALA . 18.9 mtm -90.12 -51.97 5.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.91 -179.145 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' TRP . . . . . 0.652 ' CE2' HD23 ' A' ' 14' ' ' LEU . 64.3 t90 -59.99 -33.0 71.38 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -178.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.473 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -74.44 -50.19 19.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.741 0.305 . . . . 0.0 111.659 -179.365 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -79.8 -28.67 40.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.429 -179.414 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 65' ' ' MET . . . -108.47 148.5 30.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.224 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.9 mmmm -104.25 92.81 4.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.45 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -140.4 98.81 3.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.974 -179.776 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.671 HD13 ' N ' ' A' ' 72' ' ' ILE . 0.0 OUTLIER -139.66 131.44 33.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.18 0.514 . . . . 0.0 111.767 179.883 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.415 ' HB2' ' CG ' ' A' ' 93' ' ' TYR . 0.2 OUTLIER -165.18 178.97 6.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.014 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.7 t -100.9 136.36 32.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.756 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.458 ' O ' HD22 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -130.84 -5.91 4.02 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -179.363 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.687 ' HB2' HD23 ' A' ' 89' ' ' LEU . 2.7 p90 -92.14 137.86 32.01 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.129 0.49 . . . . 0.0 111.771 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.506 ' C ' HD22 ' A' ' 89' ' ' LEU . 9.2 p-10 -104.58 91.83 4.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.229 179.049 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.485 ' HA ' HD13 ' A' ' 89' ' ' LEU . 1.8 tptp -78.41 -71.93 0.4 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.193 -179.405 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 95.62 -27.74 14.77 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.244 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.9 -163.35 0.47 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.622 0.248 . . . . 0.0 110.568 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -119.1 18.27 13.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.474 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 16.4 p -109.07 120.04 41.34 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.909 0.385 . . . . 0.0 111.011 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.555 ' O ' ' HB3' ' A' ' 87' ' ' ARG . 4.7 m-20 -116.92 -52.15 2.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.316 0.579 . . . . 0.0 109.665 178.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 4.5 mtpt -111.19 -32.94 6.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.675 178.704 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 46.0 m-85 -87.69 46.48 1.38 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.884 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 130.44 44.04 0.18 Allowed Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.951 -0.642 . . . . 0.0 111.57 -179.144 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.555 ' HB3' ' O ' ' A' ' 83' ' ' ASP . 0.0 OUTLIER -57.8 132.97 54.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.137 0.494 . . . . 0.0 110.229 179.394 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.926 ' HA2' HD11 ' A' ' 36' ' ' LEU . . . -129.92 -35.72 0.42 Allowed Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.703 -0.761 . . . . 0.0 113.538 -179.323 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.687 HD23 ' HB2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER -103.46 148.47 25.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.819 0.342 . . . . 0.0 111.554 -179.14 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.78 ' HB2' ' N ' ' A' ' 36' ' ' LEU . . . -118.62 147.19 44.0 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.435 0.532 . . . . 0.0 112.435 -179.105 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -116.04 144.99 43.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.016 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.568 HG23 ' O ' ' A' ' 92' ' ' ILE . 1.3 tt -150.11 113.57 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.84 179.603 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.415 ' CG ' ' HB2' ' A' ' 73' ' ' GLU . 7.8 t80 -108.07 123.44 48.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.069 0.462 . . . . 0.0 111.156 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.414 ' HA ' ' HG3' ' A' ' 71' ' ' LYS . . . -134.18 91.8 2.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.158 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 38.4 t70 50.39 58.07 5.9 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.484 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.764 179.769 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.457 -0.092 0 CA-C-O 120.891 0.377 . . . . 0.0 110.93 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.605 HD22 ' C ' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -70.05 157.13 38.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.93 -179.863 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -79.71 155.04 28.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.707 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.79 132.17 39.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.185 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.436 ' O ' HG23 ' A' ' 74' ' ' VAL . 7.1 tt0 -155.03 120.13 2.59 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.767 179.874 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -80.27 170.96 15.57 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.507 2.138 . . . . 0.0 112.685 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 1.065 ' HB3' HD23 ' A' ' 25' ' ' LEU . . . -136.57 -80.3 0.4 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.742 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.953 HG23 HD13 ' A' ' 72' ' ' ILE . 3.8 m 90.43 -69.36 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.651 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.49 87.02 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.818 0.342 . . . . 0.0 111.272 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.766 HG22 ' HA ' ' A' ' 25' ' ' LEU . 2.6 pp -125.48 -179.1 2.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.114 0.483 . . . . 0.0 111.726 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.9 mtpt -133.31 173.01 11.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.26 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -93.87 130.27 39.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.873 0.368 . . . . 0.0 111.255 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.616 HG21 ' CG2' ' A' ' 22' ' ' THR . 3.5 mp -140.34 157.98 25.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.974 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.462 ' N ' HG22 ' A' ' 18' ' ' ILE . 0.3 OUTLIER -98.03 146.52 25.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.975 -179.939 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.18 -129.95 10.11 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.519 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -126.16 89.32 3.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.728 0.299 . . . . 0.0 110.858 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.616 ' CG2' HG21 ' A' ' 18' ' ' ILE . 8.8 t -174.15 136.4 0.5 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.048 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.7 m -142.32 117.98 5.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.128 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.733 ' O ' HG22 ' A' ' 15' ' ' ILE . 1.4 tttp -79.68 97.68 6.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.444 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 1.065 HD23 ' HB3' ' A' ' 12' ' ' ALA . 0.4 OUTLIER -97.7 145.36 26.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.363 179.277 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.767 ' N ' ' HB1' ' A' ' 12' ' ' ALA . 14.2 ttt -72.86 99.32 2.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.922 0.392 . . . . 0.0 110.718 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -105.11 94.93 5.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.855 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 65.1 tttt 53.99 29.95 10.94 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.982 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 82.47 22.01 59.25 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.585 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -124.67 122.37 25.72 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-O 120.484 0.183 . . . . 0.0 110.753 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.61 127.53 23.97 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.416 2.077 . . . . 0.0 112.394 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.519 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 1.4 ptm -139.55 110.11 6.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.586 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.523 HG23 ' N ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -114.84 94.37 4.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.891 0.377 . . . . 0.0 111.51 -179.653 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 1.067 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 2.2 m-85 -141.14 143.34 34.21 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.11 0.481 . . . . 0.0 110.133 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.438 ' HA ' ' O ' ' A' ' 90' ' ' ALA . 6.3 ttt180 -143.63 98.12 3.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.013 -0.54 . . . . 0.0 112.063 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.635 HD22 HD22 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -142.72 88.68 2.08 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.318 178.91 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.671 ' O ' HD12 ' A' ' 37' ' ' LEU . 1.1 pp -125.89 84.04 2.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.783 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.843 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.369 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.546 ' O ' ' N ' ' A' ' 61' ' ' PHE . 89.4 p -100.59 -14.75 18.05 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 113.009 -1.905 . . . . 0.0 114.141 -178.838 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -37.0 -16.2 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -175.318 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.546 ' N ' ' O ' ' A' ' 59' ' ' SER . 5.6 t80 -52.63 -42.4 64.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 118.416 0.553 . . . . 0.0 111.379 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.446 ' HA ' ' HB2' ' A' ' 66' ' ' TRP . 32.9 p -82.38 -43.14 17.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.85 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.05 -20.12 15.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.507 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 44.8 mmtt -86.84 -63.73 1.26 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.768 0.318 . . . . 0.0 111.187 -179.736 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 2.8 ttp -89.27 -55.31 3.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.197 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' TRP . . . . . 0.861 ' CZ2' HG23 ' A' ' 72' ' ' ILE . 0.6 OUTLIER -51.4 -26.64 8.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.57 -179.738 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -94.06 -36.77 11.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.44 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -79.98 -28.15 39.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.347 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.649 ' HB3' ' HD3' ' A' ' 71' ' ' LYS . . . -108.3 150.97 26.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.094 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.31 92.96 9.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.009 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.649 ' HD3' ' HB3' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -160.35 98.86 1.29 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.923 179.936 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.953 HD13 HG23 ' A' ' 13' ' ' THR . 1.6 mp -136.05 130.96 49.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.963 0.411 . . . . 0.0 111.462 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -151.76 157.0 41.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.671 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.981 HG13 HD22 ' A' ' 25' ' ' LEU . 0.6 OUTLIER -136.17 153.08 31.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.933 0.397 . . . . 0.0 111.194 -179.987 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.584 ' HA ' HD11 ' A' ' 7' ' ' LEU . 1.8 mt-10 -163.55 78.66 0.42 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.701 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.605 ' C ' HD22 ' A' ' 7' ' ' LEU . 26.3 p90 -142.7 158.86 43.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.148 0.499 . . . . 0.0 111.523 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.23 162.76 4.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.411 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 67.3 mttt -50.55 -26.88 5.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.243 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.2 40.97 54.85 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.813 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -91.32 51.0 1.83 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.956 0.408 . . . . 0.0 110.799 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -122.68 -39.19 2.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.123 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.838 HG21 ' O ' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -59.44 122.2 13.39 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.078 0.466 . . . . 0.0 111.047 -179.827 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -115.46 -47.76 2.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.86 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.61 -61.06 2.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.113 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -80.97 -35.47 32.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.155 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.76 25.59 52.7 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.082 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.838 ' O ' HG21 ' A' ' 82' ' ' THR . 4.3 mtp85 -131.97 107.07 8.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.849 0.356 . . . . 0.0 110.645 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.472 ' O ' ' O ' ' A' ' 87' ' ' ARG . . . -54.29 -150.71 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.228 0 CA-C-N 115.736 -0.665 . . . . 0.0 113.125 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.635 HD22 HD22 ' A' ' 36' ' ' LEU . 0.5 OUTLIER -128.32 132.92 48.62 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 122.778 -0.248 . . . . 0.0 111.377 -179.223 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 1.067 ' HB3' ' O ' ' A' ' 34' ' ' PHE . . . -128.76 154.84 45.98 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 120.35 -0.54 . . . . 0.0 112.134 178.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.468 ' CD1' ' O ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -117.8 127.12 53.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.81 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 8.6 pt -79.9 130.85 35.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.129 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -117.58 117.93 30.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.836 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.41 104.58 16.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.051 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.404 ' CA ' ' HB2' ' A' ' 71' ' ' LYS . 0.4 OUTLIER 64.63 36.31 8.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.946 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 0.222 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.625 179.92 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.457 -0.093 0 CA-C-O 120.712 0.291 . . . . 0.0 110.74 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.5 mt -120.02 113.78 21.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.313 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 40.2 m-70 -71.59 99.9 2.17 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.38 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.813 ' HG3' HG23 ' A' ' 74' ' ' VAL . 5.7 mmtp -118.3 158.82 24.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.355 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -104.22 164.68 14.81 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.232 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.417 ' HA ' ' O ' ' A' ' 72' ' ' ILE . 86.6 Cg_endo -78.03 106.11 2.11 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.31 2.006 . . . . 0.0 112.857 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.513 ' O ' ' OG1' ' A' ' 13' ' ' THR . . . -158.19 124.5 4.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.389 179.726 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.711 ' HA ' ' HB3' ' A' ' 25' ' ' LEU . 76.1 m -176.31 24.88 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.888 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.535 ' O ' HD13 ' A' ' 15' ' ' ILE . 0.7 OUTLIER -98.09 83.81 3.17 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.013 -0.675 . . . . 0.0 110.06 178.983 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.535 HD13 ' O ' ' A' ' 14' ' ' LEU . 2.1 mm -127.63 -70.88 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.395 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt -145.61 140.98 27.76 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.933 179.561 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.86 133.84 39.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.966 0.413 . . . . 0.0 111.622 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.482 HG22 ' N ' ' A' ' 19' ' ' ASP . 16.5 mt -153.16 159.31 3.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.781 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.482 ' N ' HG22 ' A' ' 18' ' ' ILE . 0.5 OUTLIER -67.76 172.25 5.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.864 0.364 . . . . 0.0 111.042 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.466 ' CA ' ' HB2' ' A' ' 36' ' ' LEU . . . -69.73 65.85 0.63 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.835 -0.697 . . . . 0.0 112.472 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -148.18 -52.16 0.18 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.041 0.448 . . . . 0.0 110.143 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.477 HG23 HG21 ' A' ' 18' ' ' ILE . 0.7 OUTLIER -143.19 106.48 4.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.818 179.768 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.475 HG22 ' HB ' ' A' ' 18' ' ' ILE . 23.2 t -130.78 128.09 62.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.324 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.449 ' C ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -92.59 144.35 25.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.183 0.516 . . . . 0.0 111.944 -179.093 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.897 HD11 ' CE1' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -132.28 165.33 24.42 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.986 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.436 ' N ' HD11 ' A' ' 15' ' ' ILE . 6.7 mtt -77.18 98.62 5.15 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.446 ' HB2' HD23 ' A' ' 25' ' ' LEU . 5.6 t80 -128.17 113.94 16.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.074 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 52.01 26.25 3.63 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.95 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.31 13.82 76.92 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.779 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -124.86 140.88 36.73 Favored Pre-proline 0 C--N 1.332 -0.16 0 CA-C-O 120.666 0.27 . . . . 0.0 111.024 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -68.16 135.78 35.56 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.481 2.12 . . . . 0.0 111.973 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.741 ' SD ' HD21 ' A' ' 89' ' ' LEU . 2.5 mmt -145.11 110.46 5.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.244 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.715 ' O ' HD23 ' A' ' 89' ' ' LEU . 61.9 p -77.02 131.04 38.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.16 0.505 . . . . 0.0 112.277 -179.541 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.897 ' CE1' HD11 ' A' ' 25' ' ' LEU . 2.3 m-30 -106.57 158.73 16.71 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.976 179.461 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -115.64 148.08 40.07 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.348 179.35 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.55 ' HA ' ' HB3' ' A' ' 91' ' ' TYR . 0.1 OUTLIER -104.45 134.64 47.3 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.088 0.47 . . . . 0.0 111.682 -179.364 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.8 tp -144.25 133.74 23.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.618 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.281 0 CA-C-O 120.812 0.339 . . . . 0.0 111.053 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.044 0 CA-C-O 120.876 0.369 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.35 -38.54 89.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.832 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.51 -32.07 73.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.016 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.403 ' CZ ' ' HB3' ' A' ' 94' ' ' ALA . 0.2 OUTLIER -59.34 -51.78 68.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.641 179.905 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.441 ' HB ' ' HB3' ' A' ' 66' ' ' TRP . 51.4 p -58.2 -45.54 87.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.783 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.402 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 1.9 tttm -54.92 -19.83 7.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.34 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.19 -63.38 1.31 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.935 0.398 . . . . 0.0 111.204 -179.73 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.5 ' O ' ' N ' ' A' ' 69' ' ' ALA . 2.1 mtt -87.93 -58.87 2.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.223 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' TRP . . . . . 0.441 ' HB3' ' HB ' ' A' ' 62' ' ' THR . 74.9 t90 -51.55 -32.0 26.54 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.402 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 0.5 OUTLIER -94.44 -52.66 4.23 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -179.168 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -79.47 -28.29 41.54 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.746 0.308 . . . . 0.0 111.625 -178.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 65' ' ' MET . . . -107.69 151.21 25.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.597 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.2 mtmt -103.41 97.25 7.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.844 0.354 . . . . 0.0 111.94 -178.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.455 ' HD3' ' CB ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -166.25 96.63 0.59 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.712 178.79 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.634 HG21 ' CB ' ' A' ' 13' ' ' THR . 1.3 mp -141.47 103.83 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.148 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -136.84 151.43 49.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.845 0.355 . . . . 0.0 111.796 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.813 HG23 ' HG3' ' A' ' 9' ' ' LYS . 2.0 m -103.81 153.63 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.793 -179.556 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.56 -75.41 0.61 Allowed 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.989 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -143.39 146.33 33.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.852 0.358 . . . . 0.0 111.007 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.909 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 1.9 p30 -59.12 148.29 31.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.093 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.411 ' NZ ' ' HB2' ' A' ' 80' ' ' GLN . 0.2 OUTLIER -101.2 -61.35 1.38 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.835 179.872 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 100.89 41.17 2.71 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.884 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.411 ' HB2' ' NZ ' ' A' ' 78' ' ' LYS . 2.8 mt-30 -123.97 150.77 44.41 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.855 0.36 . . . . 0.0 110.922 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 69.1 9.97 7.64 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.24 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.473 ' CB ' ' O ' ' A' ' 85' ' ' TYR . 0.5 OUTLIER -109.3 148.42 31.06 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.658 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -84.69 -52.57 5.98 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.073 0.463 . . . . 0.0 110.079 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.9 mttt -110.51 -57.29 2.24 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 177.065 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.737 ' O ' ' N ' ' A' ' 87' ' ' ARG . 65.9 m-85 -133.35 -37.7 0.95 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 113.879 -1.51 . . . . 0.0 107.985 176.22 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLY . . . . . 0.454 ' HA3' ' HB ' ' A' ' 82' ' ' THR . . . 44.28 -36.71 0.0 OUTLIER Glycine 0 N--CA 1.472 1.086 0 C-N-CA 125.188 1.375 . . . . 0.0 115.662 177.685 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.737 ' N ' ' O ' ' A' ' 85' ' ' TYR . 0.1 OUTLIER -142.69 95.88 2.85 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 176.912 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.813 ' C ' HD13 ' A' ' 89' ' ' LEU . . . -77.42 13.03 12.04 Favored Glycine 0 C--N 1.313 -0.75 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.179 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.813 HD13 ' C ' ' A' ' 88' ' ' GLY . 0.0 OUTLIER -128.2 149.81 50.29 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 122.787 0.435 . . . . 0.0 110.229 -179.17 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.909 ' HB2' ' HA ' ' A' ' 77' ' ' ASP . . . -101.49 -178.31 3.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.023 0.44 . . . . 0.0 111.861 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.55 ' HB3' ' HA ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -71.97 145.69 48.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.834 -178.991 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.67 ' O ' HD12 ' A' ' 92' ' ' ILE . 1.3 pp -96.55 160.31 2.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.99 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -110.91 119.13 38.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.013 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.403 ' HB3' ' CZ ' ' A' ' 61' ' ' PHE . . . -97.44 93.74 6.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.082 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.416 ' N ' ' HG3' ' A' ' 71' ' ' LYS . 12.3 t0 67.05 52.46 0.87 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.873 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.405 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.598 179.85 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.7 mtpt . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.882 0.372 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.665 HD13 ' H ' ' A' ' 8' ' ' HIS . 0.2 OUTLIER -108.07 153.98 22.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.827 179.812 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 8' ' ' HIS . . . . . 0.665 ' H ' HD13 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -93.48 147.24 23.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.864 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.27 122.76 21.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.103 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -146.11 131.64 9.28 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.514 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.568 ' HA ' ' HA ' ' A' ' 73' ' ' GLU . 84.8 Cg_endo -79.75 171.13 16.0 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.293 1.995 . . . . 0.0 112.732 -179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -153.65 -136.18 0.06 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.717 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.788 HG22 ' HB2' ' A' ' 26' ' ' MET . 3.5 t -162.24 178.44 8.73 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.743 0.306 . . . . 0.0 110.799 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.645 HD13 ' N ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -97.16 94.82 7.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.988 0.423 . . . . 0.0 111.076 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.9 mt -85.84 -68.63 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.007 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.418 ' HB2' ' CG ' ' A' ' 24' ' ' LYS . 4.4 ttpp -110.05 169.74 8.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.472 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -87.12 148.31 25.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.049 0.452 . . . . 0.0 111.85 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.883 HD11 ' HG3' ' A' ' 35' ' ' ARG . 5.9 tp -111.35 119.04 58.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.156 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -118.24 28.93 8.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.835 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.38 38.17 29.65 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.345 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -147.12 -49.47 0.19 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.747 0.308 . . . . 0.0 110.834 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 71.8 p -157.97 139.58 13.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.17 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.767 ' HB ' HD13 ' A' ' 18' ' ' ILE . 12.5 p -142.43 114.05 3.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.693 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.418 ' CG ' ' HB2' ' A' ' 16' ' ' LYS . 4.4 ptpt -91.02 125.98 35.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.386 -179.626 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 21.6 mt -124.49 157.0 36.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.606 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.788 ' HB2' HG22 ' A' ' 13' ' ' THR . 0.0 OUTLIER -72.99 99.89 2.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.905 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.615 ' CD2' HG21 ' A' ' 74' ' ' VAL . 24.9 t80 -124.37 108.47 12.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.705 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 62.7 23.75 14.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.036 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 89.96 -14.14 62.73 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.92 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -110.66 144.82 31.03 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.838 0.319 . . . . 0.0 111.089 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -73.6 151.65 47.27 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.513 2.142 . . . . 0.0 112.199 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.456 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 1.7 mmm -145.15 113.77 6.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.093 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 37.2 p -89.81 86.68 6.72 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.411 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.457 ' HB2' ' O ' ' A' ' 88' ' ' GLY . 1.9 p90 -141.31 118.76 11.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.071 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.883 ' HG3' HD11 ' A' ' 18' ' ' ILE . 0.0 OUTLIER -139.89 120.27 13.98 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.347 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.736 HD13 HD13 ' A' ' 89' ' ' LEU . 0.4 OUTLIER -143.11 146.51 33.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.12 178.201 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.428 HD23 ' N ' ' A' ' 37' ' ' LEU . 0.5 OUTLIER -144.17 135.08 25.21 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.935 0.398 . . . . 0.0 111.27 -179.932 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.7 tt . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.772 179.9 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.813 0.339 . . . . 0.0 110.966 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.6 p -62.07 -19.11 62.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.123 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -51.3 -29.06 13.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.771 0.32 . . . . 0.0 111.418 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -60.18 -63.87 1.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.809 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.447 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 0.6 OUTLIER -66.92 -34.79 78.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.749 -179.978 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.418 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 13.2 mttm -51.15 -19.85 1.31 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.627 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -81.02 -61.85 1.84 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.83 0.347 . . . . 0.0 111.013 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.443 ' O ' ' N ' ' A' ' 69' ' ' ALA . 5.7 mmt -88.68 -52.56 5.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.964 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' TRP . . . . . 0.447 ' HB3' ' O ' ' A' ' 62' ' ' THR . 68.2 t90 -53.66 -27.37 27.07 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.69 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.418 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -94.51 -56.42 2.81 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.315 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -79.88 -28.4 39.91 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 65' ' ' MET . . . -104.59 144.08 32.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.826 0.346 . . . . 0.0 110.866 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -96.59 92.6 6.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.153 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.464 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -162.06 98.11 1.05 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.015 179.536 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 2.7 mp -139.54 133.09 37.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.166 0.507 . . . . 0.0 111.96 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.589 ' HB2' ' CG ' ' A' ' 93' ' ' TYR . 10.3 mt-10 -146.7 170.09 17.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.353 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.615 HG21 ' CD2' ' A' ' 27' ' ' TYR . 27.2 m -108.14 131.99 57.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.977 0.417 . . . . 0.0 111.546 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -91.49 -164.33 1.16 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.845 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.3 p90 -92.89 136.39 33.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.056 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.635 ' HA ' ' HB3' ' A' ' 90' ' ' ALA . 36.6 p30 -103.94 162.0 13.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.044 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.0 ttmt -58.92 -66.45 0.5 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.946 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 91.23 27.72 17.35 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.588 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -129.0 -54.35 1.21 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.836 0.35 . . . . 0.0 110.984 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.87 97.9 9.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.83 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.489 ' HB ' ' HA2' ' A' ' 86' ' ' GLY . 1.6 p -83.49 171.04 13.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.726 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -115.23 -51.79 2.7 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 44.3 tttm -110.83 -64.34 1.29 Allowed 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -179.35 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -133.77 2.45 3.43 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.175 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLY . . . . . 0.489 ' HA2' ' HB ' ' A' ' 82' ' ' THR . . . 128.15 51.01 0.14 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.307 -0.949 . . . . 0.0 112.601 -179.599 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 4.2 mtp85 -104.51 98.76 8.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.707 0.289 . . . . 0.0 110.991 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.457 ' O ' ' HB2' ' A' ' 34' ' ' PHE . . . -54.16 108.91 0.97 Allowed Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 178.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.736 HD13 HD13 ' A' ' 36' ' ' LEU . 0.2 OUTLIER -77.21 96.47 4.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.423 0.63 . . . . 0.0 112.63 -177.588 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.635 ' HB3' ' HA ' ' A' ' 77' ' ' ASP . . . -174.78 113.66 0.15 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.145 177.299 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.745 ' CD2' HG11 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -145.67 102.93 3.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.527 179.993 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.621 HD13 ' O ' ' A' ' 91' ' ' TYR . 32.1 mm -150.04 107.7 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.181 178.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.589 ' CG ' ' HB2' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -153.24 135.43 14.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.036 178.848 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -134.42 99.75 4.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.875 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.459 ' CA ' ' HB2' ' A' ' 71' ' ' LYS . 4.4 t0 57.89 41.55 24.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.822 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.493 -179.994 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.762 0.315 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.99 157.09 35.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.902 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -89.12 142.06 27.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.765 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.4 mmmt -83.62 107.97 16.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.017 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -140.33 133.74 15.08 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.698 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.425 ' HA ' ' HA ' ' A' ' 73' ' ' GLU . 98.4 Cg_endo -79.55 112.58 2.98 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.435 2.09 . . . . 0.0 112.636 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.647 ' HB1' ' O ' ' A' ' 26' ' ' MET . . . -166.07 104.6 0.66 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.026 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.818 HG23 HD22 ' A' ' 25' ' ' LEU . 0.3 OUTLIER -174.14 9.0 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.253 -0.43 . . . . 0.0 112.063 179.816 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.7 tp -98.67 85.08 3.26 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 120.691 -0.403 . . . . 0.0 111.346 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.608 HD11 ' N ' ' A' ' 26' ' ' MET . 32.5 mt -126.8 -68.43 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.91 178.348 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.9 tptt -130.99 122.76 27.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.297 178.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.879 ' HB2' ' CZ3' ' A' ' 66' ' ' TRP . . . -76.91 120.86 22.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.086 0.47 . . . . 0.0 112.028 -178.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.67 HD13 ' O ' ' A' ' 17' ' ' ALA . 25.0 mm -147.51 158.59 8.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.221 179.344 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.481 ' N ' HG22 ' A' ' 18' ' ' ILE . 0.8 OUTLIER -67.82 -176.16 0.63 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.534 179.836 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -66.84 70.22 0.18 Allowed Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.079 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.422 ' N ' ' O ' ' A' ' 19' ' ' ASP . 8.6 t70 -147.71 -51.98 0.19 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.912 0.386 . . . . 0.0 110.623 -179.687 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.455 ' HA ' ' O ' ' A' ' 34' ' ' PHE . 1.5 t -154.55 106.38 2.72 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.578 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.566 HG23 ' HB2' ' A' ' 34' ' ' PHE . 2.6 m -132.67 113.92 21.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.898 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.431 ' HG3' HG21 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -79.94 138.75 37.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.13 0.491 . . . . 0.0 112.011 -178.575 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.818 HD22 HG23 ' A' ' 13' ' ' THR . 0.1 OUTLIER -121.6 127.33 50.77 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.035 179.409 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.647 ' O ' ' HB1' ' A' ' 12' ' ' ALA . 0.4 OUTLIER -72.83 99.59 2.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.93 0.395 . . . . 0.0 110.886 -179.753 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -117.38 114.4 23.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.806 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 59.91 28.15 17.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.812 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 82.66 18.98 64.67 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.72 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.34 128.07 21.03 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.656 0.228 . . . . 0.0 110.952 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -74.14 126.93 10.87 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.444 2.096 . . . . 0.0 112.227 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 18.5 mmt -119.17 110.73 17.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.167 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.4 HG23 ' OG1' ' A' ' 22' ' ' THR . 14.3 m -70.98 157.13 38.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.334 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.814 ' CE1' HD11 ' A' ' 25' ' ' LEU . 1.9 m-85 -120.33 158.97 25.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.581 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -116.57 148.31 41.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.979 0.418 . . . . 0.0 111.082 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.762 HD23 ' O ' ' A' ' 37' ' ' LEU . 6.2 tt -48.71 119.46 3.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.487 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.762 ' O ' HD23 ' A' ' 36' ' ' LEU . 1.9 pp -49.06 165.23 0.06 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.912 179.515 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.464 ' O ' ' O ' ' A' ' 37' ' ' LEU . 23.0 tp . . . . . 0 N--CA 1.47 0.525 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -179.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.835 0.35 . . . . 0.0 111.38 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -88.87 -24.1 22.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.042 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -76.16 -28.85 57.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.253 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -56.88 -48.01 79.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.939 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.577 ' HB ' HD11 ' A' ' 92' ' ' ILE . 1.3 t -64.63 -15.48 61.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.383 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.5 tttp -89.14 -66.47 0.92 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.414 ' O ' ' N ' ' A' ' 68' ' ' ASN . 8.8 mttt -88.79 -64.34 1.16 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.978 0.418 . . . . 0.0 111.998 -178.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.416 ' O ' ' HB3' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -51.91 -21.53 3.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.745 -179.302 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 66' ' ' TRP . . . . . 0.879 ' CZ3' ' HB2' ' A' ' 17' ' ' ALA . 22.9 t90 -99.2 -37.34 9.33 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -179.527 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -94.11 -49.02 5.95 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -178.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.414 ' N ' ' O ' ' A' ' 64' ' ' LYS . 91.3 m-20 -79.72 -28.37 40.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.663 0.268 . . . . 0.0 111.565 -179.171 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 65' ' ' MET . . . -108.15 151.05 26.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.747 0.308 . . . . 0.0 111.092 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.2 mmtt -96.35 96.01 8.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.27 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.714 ' HB2' ' N ' ' A' ' 95' ' ' ASP . 0.0 OUTLIER -166.14 100.52 0.63 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.648 179.577 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.693 HD13 ' N ' ' A' ' 72' ' ' ILE . 0.0 OUTLIER -139.23 105.27 2.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.471 -179.659 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.425 ' HA ' ' HA ' ' A' ' 11' ' ' PRO . 2.6 mt-10 -128.73 169.7 14.19 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.249 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.527 HG22 HD13 ' A' ' 25' ' ' LEU . 21.1 t -115.18 147.4 18.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.852 179.722 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.42 ' HB2' ' CE2' ' A' ' 93' ' ' TYR . 4.8 tt0 -110.78 -69.95 0.84 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.696 0.284 . . . . 0.0 111.613 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -110.04 118.16 35.67 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.896 0.379 . . . . 0.0 111.371 -179.318 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -104.2 91.83 4.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.464 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -61.18 -83.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.043 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 91.86 -29.0 7.79 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.712 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -110.69 -38.35 5.18 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.785 0.326 . . . . 0.0 110.893 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.4 ttt-85 -75.99 63.39 1.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.81 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.414 ' CG2' ' HA2' ' A' ' 86' ' ' GLY . 10.4 p -87.7 151.09 23.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.712 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -114.97 -51.9 2.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.25 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.79 -64.03 1.32 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.866 0.365 . . . . 0.0 111.286 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -133.79 12.39 4.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.447 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLY . . . . . 0.414 ' HA2' ' CG2' ' A' ' 82' ' ' THR . . . 128.08 0.75 6.41 Favored Glycine 0 CA--C 1.519 0.342 0 C-N-CA 120.518 -0.849 . . . . 0.0 112.963 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -107.77 98.98 8.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.953 0.406 . . . . 0.0 110.978 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -117.32 -85.47 1.11 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.274 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.2 tp -102.28 101.01 11.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.721 0.296 . . . . 0.0 110.676 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.707 ' HB1' ' CD2' ' A' ' 34' ' ' PHE . . . -152.24 137.75 17.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.923 0.392 . . . . 0.0 111.506 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -142.15 122.23 13.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.635 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.577 HD11 ' HB ' ' A' ' 62' ' ' THR . 2.7 pt -89.49 149.9 3.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.832 0.349 . . . . 0.0 111.275 -179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.499 ' CD1' ' HA2' ' A' ' 96' ' ' GLY . 0.0 OUTLIER -137.77 168.09 20.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.081 179.466 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.615 ' HB1' ' HG3' ' A' ' 71' ' ' LYS . . . -94.08 99.73 11.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.715 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.714 ' N ' ' HB2' ' A' ' 71' ' ' LYS . 1.9 t0 76.6 21.0 1.34 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.125 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.499 ' HA2' ' CD1' ' A' ' 93' ' ' TYR . . . . . . . . 0 CA--C 1.517 0.184 0 C-N-CA 121.035 -0.602 . . . . 0.0 112.912 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.2 mtpt . . . . . 0 N--CA 1.458 -0.043 0 CA-C-O 120.92 0.39 . . . . 0.0 110.897 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.573 HD13 ' H ' ' A' ' 8' ' ' HIS . 0.2 OUTLIER -101.96 151.19 22.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.942 -179.96 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 8' ' ' HIS . . . . . 0.573 ' H ' HD13 ' A' ' 7' ' ' LEU . 13.7 t60 -120.56 88.92 3.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.675 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.72 158.18 29.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.01 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -104.76 158.6 31.67 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.714 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -78.87 157.31 27.42 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.426 2.084 . . . . 0.0 112.535 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.706 ' HB1' ' O ' ' A' ' 26' ' ' MET . . . -120.29 -90.25 0.58 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.318 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.662 HG23 ' O ' ' A' ' 12' ' ' ALA . 0.1 OUTLIER 175.67 164.24 0.33 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.89 0.376 . . . . 0.0 110.875 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.452 ' CB ' ' CZ2' ' A' ' 66' ' ' TRP . 1.7 pp -90.12 139.88 30.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.827 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.541 HD11 ' N ' ' A' ' 26' ' ' MET . 3.4 mt -125.08 -77.1 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.392 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.741 ' O ' HG13 ' A' ' 23' ' ' VAL . 18.9 mtpt -145.2 137.99 26.21 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.88 0.372 . . . . 0.0 110.961 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -126.35 106.3 9.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.984 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.691 HG23 ' H ' ' A' ' 19' ' ' ASP . 0.7 OUTLIER -51.28 -77.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.311 -179.858 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.691 ' H ' HG23 ' A' ' 18' ' ' ILE . 0.5 OUTLIER -118.16 -80.97 0.62 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.739 0.304 . . . . 0.0 110.841 179.896 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -174.71 33.5 0.1 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.528 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -122.08 -35.53 3.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.69 0.281 . . . . 0.0 111.039 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 t -147.03 139.58 24.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.808 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.741 HG13 ' O ' ' A' ' 16' ' ' LYS . 29.4 t -142.79 129.58 18.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.277 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.438 ' HA ' ' O ' ' A' ' 32' ' ' MET . 0.0 OUTLIER -79.65 143.68 34.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.203 -179.76 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.676 HD11 ' OH ' ' A' ' 91' ' ' TYR . 0.4 OUTLIER -136.52 165.01 26.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.645 179.797 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.706 ' O ' ' HB1' ' A' ' 12' ' ' ALA . 23.3 mmt -84.98 99.85 11.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.858 0.361 . . . . 0.0 110.87 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -115.63 95.7 5.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.868 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.6 mmtm 58.32 30.18 19.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.956 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 91.33 -14.07 64.73 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.629 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -99.31 141.42 22.81 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 120.694 0.283 . . . . 0.0 110.871 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.54 134.71 15.59 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.514 2.142 . . . . 0.0 112.249 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.455 ' HB3' ' CE1' ' A' ' 34' ' ' PHE . 3.5 mmt -129.19 110.54 12.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.926 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.72 86.75 4.15 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.918 -179.639 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.505 ' HB2' ' CD1' ' A' ' 91' ' ' TYR . 0.5 OUTLIER -137.78 107.11 6.1 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.779 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 tpt180 -140.38 127.72 21.22 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.481 HD22 ' O ' ' A' ' 89' ' ' LEU . 6.9 tp -143.12 111.06 5.99 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.349 178.354 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.676 HD11 ' HB1' ' A' ' 58' ' ' ALA . 0.6 OUTLIER -143.99 149.69 37.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.076 0.465 . . . . 0.0 111.603 -179.59 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.36 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.676 ' HB1' HD11 ' A' ' 37' ' ' LEU . . . . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.879 0.371 . . . . 0.0 111.102 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.7 t -60.08 -31.36 69.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.884 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -85.81 -29.98 23.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.199 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -60.25 -47.18 87.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.915 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.404 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 14.8 p -58.09 -50.08 74.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.82 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -21.63 9.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.107 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.3 tttm -88.44 -59.37 2.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.833 0.349 . . . . 0.0 110.961 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.8 mtt -90.27 -56.35 3.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.489 -179.756 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' TRP . . . . . 0.452 ' CZ2' ' CB ' ' A' ' 14' ' ' LEU . 28.4 t90 -53.94 -24.75 17.49 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.71 0.263 . . . . 0.0 111.71 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.32 -48.32 6.21 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.567 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.93 -28.2 39.75 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.08 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.53 ' HB3' ' HD3' ' A' ' 71' ' ' LYS . . . -105.02 151.23 24.21 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.785 0.326 . . . . 0.0 110.814 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.1 mmtt -95.37 92.95 6.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.878 -179.198 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.593 ' HB2' ' O ' ' A' ' 93' ' ' TYR . 0.0 OUTLIER -142.77 96.97 3.02 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.845 178.692 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.666 ' O ' HG23 ' A' ' 72' ' ' ILE . 0.5 OUTLIER -141.58 103.07 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.076 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.571 ' CB ' ' HB2' ' A' ' 93' ' ' TYR . 0.0 OUTLIER -166.81 178.65 5.75 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.664 -0.414 . . . . 0.0 111.263 177.862 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 90' ' ' ALA . 11.7 p -123.45 153.02 28.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.889 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -99.52 -118.38 0.15 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.588 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 54.8 p90 -107.07 134.15 50.63 Favored 'General case' 0 N--CA 1.457 -0.085 0 CA-C-O 120.798 0.332 . . . . 0.0 111.039 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.7 p-10 -78.7 117.95 20.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.942 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.25 -34.0 19.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.996 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 57.64 28.78 60.37 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.492 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -91.97 -64.05 1.16 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.718 0.294 . . . . 0.0 110.9 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -54.81 42.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.826 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.425 HG23 ' O ' ' A' ' 82' ' ' THR . 11.9 t -70.72 120.86 16.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.622 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -115.38 -51.27 2.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.971 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.7 pttm -101.41 -29.34 12.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.898 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.14 -35.65 76.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.54 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 67.7 24.19 74.04 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.684 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.427 ' HA ' ' CE2' ' A' ' 34' ' ' PHE . 0.6 OUTLIER -121.32 97.95 5.75 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.26 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -61.71 115.88 8.57 Favored Glycine 0 N--CA 1.452 -0.296 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 178.515 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.481 ' O ' HD22 ' A' ' 36' ' ' LEU . 1.5 mt -77.25 97.3 4.79 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.151 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.487 ' O ' HG23 ' A' ' 74' ' ' VAL . . . -174.17 114.24 0.19 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.116 177.722 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.676 ' OH ' HD11 ' A' ' 25' ' ' LEU . 0.3 OUTLIER -145.21 94.35 2.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.476 179.156 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 6.6 pt -150.17 108.86 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 C-N-CA 120.409 -0.516 . . . . 0.0 111.953 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.593 ' O ' ' HB2' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -151.65 168.78 23.91 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.387 179.294 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -122.07 106.48 11.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.833 0.349 . . . . 0.0 111.233 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.4 t0 52.07 26.21 3.66 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.835 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.268 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.57 -179.746 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.7 mttt . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.84 0.352 . . . . 0.0 110.858 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.408 HD13 ' C ' ' A' ' 75' ' ' GLU . 1.7 pp -69.96 156.9 38.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.146 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 12.9 t60 -90.49 159.1 16.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.704 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.52 120.41 42.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.915 0.388 . . . . 0.0 111.356 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.826 ' O ' HG23 ' A' ' 74' ' ' VAL . 12.5 mt-10 -137.83 129.02 15.98 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.336 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.757 ' HA ' ' HA ' ' A' ' 73' ' ' GLU . 87.7 Cg_endo -82.76 158.84 16.24 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.42 2.08 . . . . 0.0 112.939 -179.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.933 ' HB2' HD12 ' A' ' 25' ' ' LEU . . . -115.84 -129.87 0.3 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.56 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.645 HG23 ' O ' ' A' ' 12' ' ' ALA . 0.1 OUTLIER 175.99 -86.74 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.218 0 O-C-N 122.269 -0.27 . . . . 0.0 111.698 179.784 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.37 112.39 23.97 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.852 0.358 . . . . 0.0 111.234 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.807 HD11 HG21 ' A' ' 72' ' ' ILE . 2.6 mp -125.47 160.21 31.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.241 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.637 ' O ' HG12 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -115.19 122.8 47.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.374 179.439 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.405 ' HA ' HG12 ' A' ' 23' ' ' VAL . . . -112.29 123.61 50.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.447 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.636 HG23 ' H ' ' A' ' 19' ' ' ASP . 0.5 OUTLIER -117.87 -89.43 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.812 179.755 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.636 ' H ' HG23 ' A' ' 18' ' ' ILE . 1.0 OUTLIER -118.32 28.84 8.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.716 0.294 . . . . 0.0 110.977 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.551 ' HA3' HD23 ' A' ' 36' ' ' LEU . . . 61.32 57.42 18.34 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.233 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -147.19 -44.26 0.17 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.805 0.336 . . . . 0.0 110.795 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 54.6 p -132.51 106.87 8.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.182 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.637 HG12 ' O ' ' A' ' 16' ' ' LYS . 27.5 m -128.76 113.71 30.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.52 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.537 ' HB3' HG23 ' A' ' 33' ' ' THR . 12.6 ptmt -90.35 105.54 17.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.681 -179.257 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.933 HD12 ' HB2' ' A' ' 12' ' ' ALA . 1.7 pt? -108.1 165.05 11.77 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.347 179.404 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 2.7 ttm -77.37 99.85 5.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.857 0.361 . . . . 0.0 111.047 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.407 ' CE2' HG21 ' A' ' 74' ' ' VAL . 36.6 t80 -115.0 100.33 8.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.744 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 61.16 31.04 19.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.896 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.39 24.28 66.04 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.549 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -142.1 120.89 7.74 Favored Pre-proline 0 C--N 1.33 -0.257 0 O-C-N 122.769 -0.254 . . . . 0.0 110.981 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -59.72 132.41 45.3 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.353 2.035 . . . . 0.0 112.002 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 11.7 mtp -134.49 118.06 16.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.978 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.537 HG23 ' HB3' ' A' ' 24' ' ' LYS . 0.8 OUTLIER -95.59 127.21 41.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.102 -179.906 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.59 ' HE1' HD22 ' A' ' 25' ' ' LEU . 35.2 p90 -141.03 158.18 44.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.985 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -92.74 148.14 22.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.774 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.551 HD23 ' HA3' ' A' ' 20' ' ' GLY . 4.7 pp -48.98 153.95 0.81 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.297 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.765 ' HB3' ' HB3' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -66.96 155.05 39.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.093 -179.878 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.447 HD23 ' H ' ' A' ' 38' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.818 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.088 0 CA-C-O 120.735 0.303 . . . . 0.0 111.412 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 94.8 p -92.93 -16.04 25.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.538 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -83.84 -61.76 1.74 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.716 0.293 . . . . 0.0 111.451 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -54.78 -53.87 49.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.259 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.522 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 36.9 p -59.7 -21.05 60.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.233 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.403 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 11.5 tttt -89.11 -19.48 25.49 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.334 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp -88.59 -64.18 1.18 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.857 -179.27 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -89.14 -54.31 4.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.685 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' TRP . . . . . 0.522 ' HB3' ' O ' ' A' ' 62' ' ' THR . 37.8 t90 -58.75 -18.55 32.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.713 -179.281 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.403 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -90.81 -44.6 9.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.826 0.346 . . . . 0.0 111.192 -179.935 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -79.99 -28.04 39.56 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.184 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -108.04 151.21 26.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.86 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.2 ptpt -100.83 92.6 5.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.407 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.416 ' HG3' ' HA ' ' A' ' 94' ' ' ALA . 0.0 OUTLIER -138.26 98.03 3.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.052 179.423 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.807 HG21 HD11 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -139.86 119.88 13.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.771 0.319 . . . . 0.0 111.596 -179.545 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.757 ' HA ' ' HA ' ' A' ' 11' ' ' PRO . 10.4 mt-10 -149.25 172.11 15.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.479 179.642 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.826 HG23 ' O ' ' A' ' 10' ' ' GLU . 34.9 t -100.85 141.57 17.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.4 -179.296 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.408 ' C ' HD13 ' A' ' 7' ' ' LEU . 0.9 OUTLIER -135.14 -2.86 2.5 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -179.744 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.467 ' CD1' ' HB3' ' A' ' 91' ' ' TYR . 0.0 OUTLIER -92.68 164.32 13.43 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.884 0.373 . . . . 0.0 111.573 -179.634 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.406 ' CB ' ' HB3' ' A' ' 7' ' ' LEU . 3.1 t70 -100.85 139.19 36.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.911 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.0 pttp -68.77 108.44 3.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.954 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 88.08 41.11 6.35 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.481 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.12 -63.69 1.36 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.785 0.326 . . . . 0.0 110.816 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -162.12 94.82 0.93 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.007 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.449 ' HB ' ' HA2' ' A' ' 86' ' ' GLY . 7.6 p -74.37 154.31 38.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.769 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -115.23 -51.8 2.7 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.293 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.6 tptt -110.74 -64.0 1.33 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.788 0.328 . . . . 0.0 111.612 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.415 ' O ' ' CG ' ' A' ' 85' ' ' TYR . 81.9 t80 -133.9 11.15 3.96 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.623 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLY . . . . . 0.449 ' HA2' ' HB ' ' A' ' 82' ' ' THR . . . 128.09 -15.33 6.18 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.573 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -90.3 98.76 11.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.781 0.324 . . . . 0.0 110.929 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -147.11 -44.54 0.03 OUTLIER Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.438 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.41 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 4.3 mm? -81.5 148.36 29.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.897 0.38 . . . . 0.0 110.904 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.765 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . . . -102.67 142.56 33.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.206 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.718 ' HB2' HG13 ' A' ' 74' ' ' VAL . 1.8 p90 -141.04 88.01 2.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.012 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -150.2 141.2 16.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.081 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.442 ' CD1' ' HG3' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -123.36 117.99 26.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.619 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.416 ' HA ' ' HG3' ' A' ' 71' ' ' LYS . . . -111.43 91.87 3.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.051 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 58.2 23.81 10.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.065 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.356 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.551 -179.974 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 tppm? . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.813 0.34 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.833 HD13 ' N ' ' A' ' 8' ' ' HIS . 0.7 OUTLIER -96.2 146.62 24.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.92 -179.883 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 8' ' ' HIS . . . . . 0.833 ' N ' HD13 ' A' ' 7' ' ' LEU . 2.1 m-70 -114.03 109.77 18.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.912 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.787 ' CB ' HG23 ' A' ' 74' ' ' VAL . 1.0 OUTLIER -122.04 159.09 27.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.154 -179.852 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -104.09 164.27 15.66 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.627 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.447 ' CA ' ' HG3' ' A' ' 73' ' ' GLU . 91.0 Cg_endo -78.48 150.07 24.7 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.596 2.197 . . . . 0.0 112.692 -179.392 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.726 ' HB1' ' O ' ' A' ' 26' ' ' MET . . . -121.34 -81.86 0.64 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.194 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.67 HG23 ' O ' ' A' ' 12' ' ' ALA . 0.1 OUTLIER 171.36 131.25 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.725 0.298 . . . . 0.0 111.001 -179.984 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.742 HD13 ' N ' ' A' ' 15' ' ' ILE . 0.3 OUTLIER -98.19 130.29 44.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.994 179.716 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.742 ' N ' HD13 ' A' ' 14' ' ' LEU . 0.8 OUTLIER -84.46 -51.52 13.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.231 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.421 ' H ' HG13 ' A' ' 15' ' ' ILE . 14.2 tttm -164.46 151.26 11.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.518 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.687 ' HA ' HG12 ' A' ' 23' ' ' VAL . . . -125.43 148.05 48.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.406 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.9 pt -123.82 -167.0 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.914 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -71.19 62.7 0.33 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.796 0.332 . . . . 0.0 111.431 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.427 ' HA3' ' CD2' ' A' ' 36' ' ' LEU . . . 44.33 77.22 0.1 OUTLIER Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.989 -0.625 . . . . 0.0 113.095 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -147.64 -46.26 0.17 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.98 0.419 . . . . 0.0 110.796 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -167.99 106.93 0.52 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.873 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.776 HG22 ' O ' ' A' ' 34' ' ' PHE . 32.6 m -121.35 113.85 41.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.672 179.582 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.4 ' O ' HG13 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -87.66 147.4 25.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.358 -179.548 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.768 HD21 ' CD2' ' A' ' 34' ' ' PHE . 0.1 OUTLIER -137.99 137.21 37.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.176 179.622 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.726 ' O ' ' HB1' ' A' ' 12' ' ' ALA . 3.1 tpt -72.75 99.43 2.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.923 0.392 . . . . 0.0 110.863 -179.52 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -118.78 116.22 26.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.702 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 25.4 mmtm 58.86 28.09 17.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.89 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.12 25.5 66.28 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.553 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -142.07 113.07 6.28 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 120.453 0.168 . . . . 0.0 110.901 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.83 141.0 95.9 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.477 2.118 . . . . 0.0 112.271 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.439 ' HB3' ' CZ ' ' A' ' 34' ' ' PHE . 0.6 OUTLIER -142.2 110.92 6.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.979 -179.848 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.422 ' O ' ' CD1' ' A' ' 34' ' ' PHE . 1.4 t -78.28 139.9 38.86 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.196 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.776 ' O ' HG22 ' A' ' 23' ' ' VAL . 26.0 m-85 -141.39 138.51 33.04 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.194 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -101.11 148.07 25.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.641 179.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.447 ' O ' HD12 ' A' ' 36' ' ' LEU . 0.3 OUTLIER -56.57 169.3 0.48 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.34 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.685 ' H ' HD13 ' A' ' 37' ' ' LEU . 0.0 OUTLIER -95.73 163.06 13.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.932 179.832 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.772 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.805 0.336 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 t -71.59 -24.12 61.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.063 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -55.5 -23.24 24.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.371 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -53.38 -52.06 60.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.085 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.405 ' O ' ' N ' ' A' ' 66' ' ' TRP . 1.3 p -60.98 -47.86 84.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.966 0.412 . . . . 0.0 110.914 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.2 mtmt -55.7 -20.03 12.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.358 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.4 tptt -84.98 -59.8 2.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.722 0.296 . . . . 0.0 111.37 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 14.0 mtt -90.01 -49.9 6.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.313 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' TRP . . . . . 0.862 ' CE2' HG22 ' A' ' 72' ' ' ILE . 10.0 t-105 -54.79 -34.72 63.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.303 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -94.49 -52.13 4.46 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -79.79 -28.38 40.3 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.353 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.637 ' HB3' ' HD3' ' A' ' 71' ' ' LYS . . . -107.22 151.16 25.8 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.839 0.352 . . . . 0.0 111.224 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.4 tttt -89.69 92.99 9.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.568 -179.204 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.637 ' HD3' ' HB3' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -166.22 98.33 0.61 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.556 179.096 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.862 HG22 ' CE2' ' A' ' 66' ' ' TRP . 4.8 pt -139.9 128.79 27.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.0 0.428 . . . . 0.0 111.828 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.447 ' HG3' ' CA ' ' A' ' 11' ' ' PRO . 0.2 OUTLIER -162.42 171.02 17.81 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.032 179.605 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.787 HG23 ' CB ' ' A' ' 9' ' ' LYS . 0.4 OUTLIER -111.28 152.99 13.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.809 179.699 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -93.51 -79.66 0.4 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.521 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.42 ' O ' ' CE1' ' A' ' 91' ' ' TYR . 7.0 p90 -129.73 141.44 50.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.807 0.337 . . . . 0.0 111.324 -179.57 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -104.05 110.38 22.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.748 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.421 ' HB2' HD21 ' A' ' 89' ' ' LEU . 1.6 tttt -58.83 -35.23 72.57 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.903 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 106.16 28.04 5.38 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.431 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -106.97 161.7 14.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.79 0.329 . . . . 0.0 110.839 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.77 45.15 2.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.883 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 1.8 p -95.88 126.49 41.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.945 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -115.12 -50.85 2.74 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.948 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -104.64 -21.67 13.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.139 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -55.45 -30.64 60.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.235 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 125.19 51.35 0.18 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.535 -0.841 . . . . 0.0 112.554 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.584 ' NE ' HD12 ' A' ' 89' ' ' LEU . 1.7 ttt85 -58.75 112.85 1.78 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.883 0.373 . . . . 0.0 110.959 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -105.32 22.07 33.72 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.779 -0.725 . . . . 0.0 112.561 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.584 HD12 ' NE ' ' A' ' 87' ' ' ARG . 38.2 mt -78.06 148.02 34.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.715 0.293 . . . . 0.0 110.695 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -105.95 134.29 49.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.033 0.444 . . . . 0.0 111.502 -179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.756 ' HB3' HG12 ' A' ' 74' ' ' VAL . 96.9 m-85 -142.12 90.22 2.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.456 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.623 HD13 ' O ' ' A' ' 91' ' ' TYR . 25.3 mm -133.82 116.89 24.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.983 0.421 . . . . 0.0 111.818 -179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.44 ' HB3' ' HB3' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -151.13 117.78 5.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.326 179.219 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.512 ' HB1' ' HG3' ' A' ' 71' ' ' LYS . . . -94.38 113.36 25.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.679 -179.349 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.512 ' N ' ' HB2' ' A' ' 71' ' ' LYS . 16.3 t70 49.97 25.91 1.82 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.985 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.41 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.237 -179.762 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.856 0.36 . . . . 0.0 110.811 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.97 141.17 34.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.865 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -93.63 159.07 15.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.846 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.4 mttp -75.86 107.9 8.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.021 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.771 ' O ' HG12 ' A' ' 74' ' ' VAL . 2.4 mt-10 -139.13 143.54 37.11 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.521 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.522 ' HA ' ' HA ' ' A' ' 73' ' ' GLU . 84.2 Cg_endo -83.75 164.37 13.98 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.476 2.117 . . . . 0.0 112.711 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.816 ' HB1' HD22 ' A' ' 25' ' ' LEU . . . -119.29 104.69 10.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.999 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 44.7 p -64.69 80.94 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.273 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.745 HD22 ' HB ' ' A' ' 62' ' ' THR . 3.2 tt -69.7 120.96 16.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.431 179.559 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 26.4 mt -125.27 -69.86 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.863 ' O ' HG13 ' A' ' 23' ' ' VAL . 3.7 pttt -121.68 145.95 47.5 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.925 0.393 . . . . 0.0 111.435 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.761 ' HB2' HG22 ' A' ' 23' ' ' VAL . . . -124.08 147.52 47.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.868 179.648 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.6 mm -96.81 -88.92 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.346 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -118.25 107.32 13.77 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.8 0.333 . . . . 0.0 111.045 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 98.67 -113.99 4.89 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.447 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -123.25 16.39 9.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.599 0.237 . . . . 0.0 111.159 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.6 t -74.85 106.78 6.55 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.893 0.378 . . . . 0.0 110.725 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.863 HG13 ' O ' ' A' ' 16' ' ' LYS . 16.8 t -128.77 134.67 63.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.966 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.523 ' CD ' HG23 ' A' ' 33' ' ' THR . 0.0 OUTLIER -79.73 97.86 6.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.707 -179.928 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.816 HD22 ' HB1' ' A' ' 12' ' ' ALA . 0.2 OUTLIER -99.38 142.53 30.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.867 -179.769 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.76 100.0 3.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.915 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -96.73 100.42 11.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.873 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.9 tttm 56.31 31.35 18.43 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.988 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 90.54 20.92 39.12 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.823 -0.704 . . . . 0.0 112.576 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.89 112.5 6.88 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.572 0.225 . . . . 0.0 110.778 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.2 129.49 21.8 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.351 2.034 . . . . 0.0 112.358 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 34' ' ' PHE . 33.6 mmm -145.04 118.7 9.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.933 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.523 HG23 ' CD ' ' A' ' 24' ' ' LYS . 0.8 OUTLIER -70.38 135.34 48.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.077 -179.966 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.726 ' HB3' ' HB3' ' A' ' 90' ' ' ALA . 27.0 m-85 -140.69 152.75 45.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.907 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtt-85 -117.3 148.0 42.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.972 0.415 . . . . 0.0 111.081 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.653 HD12 ' HB3' ' A' ' 91' ' ' TYR . 35.0 tp -78.06 138.39 38.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.786 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.71 HD23 ' O ' ' A' ' 37' ' ' LEU . 8.5 tt -82.83 94.34 7.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.804 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.421 HD23 ' HG ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.909 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.807 0.337 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.88 ' O ' HG22 ' A' ' 62' ' ' THR . 20.7 p -69.52 -24.54 63.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.238 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -54.72 -23.51 18.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.613 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -55.1 -31.11 60.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.815 0.34 . . . . 0.0 111.198 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.88 HG22 ' O ' ' A' ' 59' ' ' SER . 13.0 t -79.07 -17.48 55.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.279 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 67' ' ' GLU . 0.5 OUTLIER -89.41 -57.28 2.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.847 0.356 . . . . 0.0 111.441 -179.73 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.0 mtmp? -88.65 -59.18 2.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.205 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.847 ' HA ' ' HB3' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -55.67 -20.36 13.86 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.664 -179.347 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 66' ' ' TRP . . . . . 0.447 ' CE2' ' CG ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -99.22 -33.71 10.65 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.359 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.413 ' HB2' ' O ' ' A' ' 63' ' ' LYS . 5.2 mt-10 -94.0 -56.32 2.91 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 -179.534 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -80.17 -28.87 38.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.892 0.377 . . . . 0.0 110.991 -179.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.847 ' HB3' ' HA ' ' A' ' 65' ' ' MET . . . -108.78 152.6 24.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.698 179.489 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.401 ' HG2' ' HB3' ' A' ' 95' ' ' ASP . 0.0 OUTLIER -52.48 163.74 0.4 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.46 -179.754 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.447 ' CG ' ' CE2' ' A' ' 66' ' ' TRP . 0.1 OUTLIER -84.9 162.06 19.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.108 0.48 . . . . 0.0 111.486 -178.622 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.959 HD13 HG22 ' A' ' 92' ' ' ILE . 1.1 pp -102.83 145.22 12.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.849 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.522 ' HA ' ' HA ' ' A' ' 11' ' ' PRO . 44.5 mt-10 -127.89 179.1 5.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.634 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.771 HG12 ' O ' ' A' ' 10' ' ' GLU . 10.6 p -112.34 140.97 29.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.907 0.384 . . . . 0.0 111.055 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -106.88 -66.89 0.98 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.02 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 35.8 p90 -143.0 129.35 19.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.947 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.53 157.84 15.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.993 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -49.56 77.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.811 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 64.0 32.28 83.65 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.591 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -101.57 9.39 41.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.614 0.245 . . . . 0.0 111.315 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 26.4 mtm180 54.57 95.43 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.714 0.292 . . . . 0.0 111.175 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 41.7 m -62.2 148.98 42.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.908 0.385 . . . . 0.0 110.664 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -115.29 -40.18 3.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.287 -179.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.41 -63.11 1.02 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.245 -179.653 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -127.36 -35.15 2.21 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.15 -179.834 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 109.56 49.8 0.73 Allowed Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.728 -0.749 . . . . 0.0 111.845 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.403 ' HB2' ' CZ ' ' A' ' 87' ' ' ARG . 2.5 mtm105 -131.92 101.77 5.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.782 0.325 . . . . 0.0 111.022 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -48.83 171.44 0.07 OUTLIER Glycine 0 CA--C 1.518 0.26 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.415 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.4 mp -111.19 112.66 24.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.84 0.352 . . . . 0.0 111.192 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.726 ' HB3' ' HB3' ' A' ' 34' ' ' PHE . . . -128.62 130.08 46.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.798 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.653 ' HB3' HD12 ' A' ' 36' ' ' LEU . 0.0 OUTLIER -98.85 149.82 22.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.066 -179.762 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.959 HG22 HD13 ' A' ' 72' ' ' ILE . 2.7 pp -79.88 160.12 4.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.056 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.589 ' O ' HG22 ' A' ' 72' ' ' ILE . 5.8 m-85 -140.85 168.23 20.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.947 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.84 112.52 24.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.996 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.401 ' HB3' ' HG2' ' A' ' 70' ' ' LYS . 3.9 p30 45.21 41.93 6.46 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.412 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.29 0 C-N-CA 120.657 -0.783 . . . . 0.0 112.673 179.955 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.6 tptt . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.826 0.346 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.601 HD11 ' HE2' ' A' ' 27' ' ' TYR . 0.5 OUTLIER -76.4 120.26 21.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.005 179.98 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 8' ' ' HIS . . . . . 0.414 ' CE1' ' OH ' ' A' ' 27' ' ' TYR . 12.8 p-80 -70.99 157.19 38.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.703 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.6 mmtp -94.98 112.65 24.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.423 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.0 113.75 32.67 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.246 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.43 ' HA ' ' O ' ' A' ' 72' ' ' ILE . 83.1 Cg_endo -86.65 109.31 0.85 Allowed 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.513 2.142 . . . . 0.0 113.223 -178.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -166.42 -78.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.556 179.429 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.636 HG22 ' HB2' ' A' ' 25' ' ' LEU . 30.1 p 41.88 28.74 0.1 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 179.176 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.459 ' O ' HD13 ' A' ' 15' ' ' ILE . 1.0 OUTLIER -98.16 85.55 3.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.857 0.36 . . . . 0.0 110.563 179.411 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.475 HG21 ' HG2' ' A' ' 24' ' ' LYS . 10.5 mm -126.29 -69.81 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.88 179.556 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -141.85 173.04 11.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.304 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -122.35 140.0 53.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.034 0.445 . . . . 0.0 111.554 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.857 HG22 HG12 ' A' ' 23' ' ' VAL . 7.8 tt -173.6 164.23 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.768 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.42 171.97 5.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.784 0.326 . . . . 0.0 110.872 -179.656 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -60.86 82.98 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.617 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -147.27 -49.66 0.18 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.083 0.468 . . . . 0.0 110.47 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 t -172.06 106.58 0.2 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.515 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.857 HG12 HG22 ' A' ' 18' ' ' ILE . 35.9 m -122.52 127.59 75.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.122 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.475 ' HG2' HG21 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -79.21 133.99 36.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.864 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.649 HD23 ' O ' ' A' ' 32' ' ' MET . 0.5 OUTLIER -126.29 148.08 49.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.632 179.975 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.74 101.81 3.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.054 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.601 ' HE2' HD11 ' A' ' 7' ' ' LEU . 3.0 t80 -119.81 120.53 36.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.745 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.3 pttt 49.09 28.11 1.98 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.341 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.65 10.36 85.91 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.82 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.429 ' HA ' ' HD3' ' A' ' 31' ' ' PRO . 0.1 OUTLIER -121.97 142.46 36.44 Favored Pre-proline 0 CA--C 1.53 0.197 0 CA-C-N 116.726 0.263 . . . . 0.0 110.888 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 30' ' ' GLN . 35.0 Cg_exo -59.87 127.56 23.83 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.493 2.129 . . . . 0.0 112.264 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.649 ' O ' HD23 ' A' ' 25' ' ' LEU . 25.6 mmt -145.21 110.75 5.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.782 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' A' ' 23' ' ' VAL . 1.6 t -101.41 86.93 3.08 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.878 0.37 . . . . 0.0 111.829 -179.545 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.65 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -113.48 107.65 16.11 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.961 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.818 ' HA ' ' O ' ' A' ' 90' ' ' ALA . 16.5 tpt180 -143.88 95.01 2.66 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.202 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.927 HD22 HD23 ' A' ' 89' ' ' LEU . 0.1 OUTLIER -145.39 88.42 1.86 Allowed 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.386 178.551 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.655 HD23 ' HE ' ' A' ' 35' ' ' ARG . 3.2 pp -110.02 126.35 53.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.003 0.43 . . . . 0.0 110.754 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.641 -179.352 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.081 0 CA-C-O 120.862 0.363 . . . . 0.0 111.106 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.7 t -77.73 -16.02 58.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.406 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -50.89 -29.52 12.17 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.827 0.346 . . . . 0.0 111.5 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.52 ' HB3' HD11 ' A' ' 92' ' ' ILE . 4.7 m-85 -57.48 -34.82 69.43 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.867 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.539 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 29.3 p -91.17 -15.29 29.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.215 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.428 ' O ' ' HB2' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -89.69 -56.96 3.04 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -179.264 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.8 tmtt? -89.18 -64.57 1.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.521 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.496 ' HA ' ' HB3' ' A' ' 69' ' ' ALA . 0.5 OUTLIER -59.43 -20.47 55.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.464 -178.311 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 66' ' ' TRP . . . . . 0.539 ' HB3' ' O ' ' A' ' 62' ' ' THR . 23.9 t90 -99.39 -33.83 10.54 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -179.067 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.428 ' HB2' ' O ' ' A' ' 63' ' ' LYS . 9.7 mm-40 -94.12 -53.57 3.91 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 -179.0 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -79.75 -28.32 40.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.654 0.264 . . . . 0.0 111.578 -178.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.496 ' HB3' ' HA ' ' A' ' 65' ' ' MET . . . -108.23 151.29 26.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.813 0.339 . . . . 0.0 111.23 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.1 mtmp? -97.94 94.83 7.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.274 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.511 ' HG3' ' HB1' ' A' ' 94' ' ' ALA . 0.0 OUTLIER -164.45 98.95 0.81 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.502 179.567 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.467 HG22 ' CD1' ' A' ' 66' ' ' TRP . 0.0 OUTLIER -133.48 127.48 53.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.12 179.864 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -162.87 158.26 22.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.735 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.604 HG11 HD13 ' A' ' 25' ' ' LEU . 7.3 m -133.54 152.52 35.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.145 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -157.54 93.55 1.3 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.864 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.56 ' CD1' ' HB2' ' A' ' 90' ' ' ALA . 42.0 p90 -143.13 118.11 10.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.155 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -91.91 91.9 8.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.606 179.683 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.482 ' HE3' HD13 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -94.52 -68.83 0.78 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.126 -179.719 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 64.13 27.31 71.27 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.352 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -129.18 116.05 18.61 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.977 0.418 . . . . 0.0 110.8 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.36 102.04 0.16 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.916 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.54 HG21 ' H ' ' A' ' 87' ' ' ARG . 26.7 m -58.77 149.12 27.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.44 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -115.74 -48.78 2.75 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -178.903 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.33 -63.17 0.58 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.309 -0.405 . . . . 0.0 112.049 -178.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -133.31 -35.33 1.03 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.788 0.328 . . . . 0.0 111.25 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLY . . . . . 0.42 ' HA2' ' HB ' ' A' ' 82' ' ' THR . . . 120.55 34.61 0.92 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.816 -179.554 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.54 ' H ' HG21 ' A' ' 82' ' ' THR . 0.1 OUTLIER -138.89 120.38 15.02 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.104 0.478 . . . . 0.0 110.945 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -75.01 -140.16 0.7 Allowed Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 115.791 -0.64 . . . . 0.0 112.759 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.927 HD23 HD22 ' A' ' 36' ' ' LEU . 3.4 mp -128.46 116.01 19.05 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 122.109 0.163 . . . . 0.0 111.134 -179.409 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.818 ' O ' ' HA ' ' A' ' 35' ' ' ARG . . . -136.33 161.98 34.3 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 178.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.497 ' N ' ' CD1' ' A' ' 91' ' ' TYR . 0.0 OUTLIER -132.07 158.07 42.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.403 -178.874 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.52 HD11 ' HB3' ' A' ' 61' ' ' PHE . 2.4 pp -79.94 148.16 6.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.342 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -140.17 129.69 24.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.878 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.511 ' HB1' ' HG3' ' A' ' 71' ' ' LYS . . . -83.98 110.23 18.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.378 -179.755 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.501 ' N ' ' HB2' ' A' ' 71' ' ' LYS . 1.5 t70 60.72 20.22 10.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.685 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.518 -179.939 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.755 0.312 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.2 t -85.94 113.1 21.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.886 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.3 t -75.28 114.07 13.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.918 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.76 123.55 28.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.764 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.2 ttpp -72.32 107.09 4.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.026 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -109.0 121.3 44.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.669 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.519 HD21 ' H ' ' A' ' 77' ' ' ASP . 1.5 pp -87.8 120.34 29.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.115 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -81.39 88.8 6.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.515 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.548 ' HE2' HG21 ' A' ' 74' ' ' VAL . 1.8 tttt -88.11 159.45 18.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.409 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.16 165.39 13.69 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.202 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.497 ' HB3' ' CG ' ' A' ' 73' ' ' GLU . 93.2 Cg_endo -77.55 163.14 29.81 Favored 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.347 2.031 . . . . 0.0 112.289 -178.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.663 ' HB3' HD23 ' A' ' 25' ' ' LEU . . . -115.56 -165.38 1.03 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.13 0.491 . . . . 0.0 111.716 -179.148 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.5 p -116.36 -174.89 2.64 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.06 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.515 HD22 ' O ' ' A' ' 62' ' ' THR . 61.1 tp -98.34 113.86 25.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.814 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 22.4 mm -125.18 -43.88 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.914 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.909 ' O ' HG13 ' A' ' 23' ' ' VAL . 6.3 tttt -142.12 141.54 32.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.716 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -127.01 119.32 26.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.153 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.931 HD12 HG23 ' A' ' 22' ' ' THR . 23.7 mt -150.61 152.88 11.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.096 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -68.6 76.8 0.29 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.893 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 48.51 74.05 0.29 Allowed Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.529 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.412 ' HB2' HG21 ' A' ' 18' ' ' ILE . 71.9 m-20 -147.8 -48.7 0.17 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.129 0.49 . . . . 0.0 110.575 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.931 HG23 HD12 ' A' ' 18' ' ' ILE . 1.3 t -169.87 106.57 0.35 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.676 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.909 HG13 ' O ' ' A' ' 16' ' ' LYS . 41.5 t -127.24 113.42 32.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.526 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.38 127.47 32.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.264 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.663 HD23 ' HB3' ' A' ' 12' ' ' ALA . 7.1 mp -114.6 139.06 49.92 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.334 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.86 99.39 2.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.914 0.388 . . . . 0.0 110.793 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -116.36 115.39 25.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.751 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.3 ttmp? 63.84 25.23 13.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.013 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 93.88 -13.97 66.29 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.642 -0.789 . . . . 0.0 112.884 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -112.3 139.45 22.55 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.835 0.318 . . . . 0.0 111.011 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -79.21 139.02 14.61 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.684 2.256 . . . . 0.0 112.419 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.485 ' HB3' ' CZ ' ' A' ' 34' ' ' PHE . 3.1 mmt -139.34 128.22 23.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.935 0.397 . . . . 0.0 111.029 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.485 HG21 ' OG1' ' A' ' 22' ' ' THR . 86.7 m -79.31 127.8 32.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.905 -179.425 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.989 ' CB ' ' HB3' ' A' ' 90' ' ' ALA . 38.0 m-85 -141.33 130.92 23.98 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.45 179.083 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -143.33 96.26 2.89 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.754 HD21 ' OD2' ' A' ' 83' ' ' ASP . 0.2 OUTLIER -144.34 87.29 1.87 Allowed 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.364 177.497 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.617 ' O ' HD23 ' A' ' 38' ' ' LEU . 0.6 OUTLIER -145.71 103.9 3.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.931 0.396 . . . . 0.0 111.267 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.617 HD23 ' O ' ' A' ' 37' ' ' LEU . 55.9 mt -149.88 113.03 4.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.006 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 19.3 t -142.0 126.5 16.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.998 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -135.24 100.27 4.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.114 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 35.9 m -157.12 101.08 1.93 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.841 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.407 ' HG2' ' HA ' ' A' ' 47' ' ' PRO . 56.2 Cg_endo -70.36 163.05 40.14 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.437 2.091 . . . . 0.0 112.507 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -73.33 -16.24 61.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.382 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -60.84 151.16 30.65 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.677 0.275 . . . . 0.0 110.772 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 4.1 mtmt -45.36 -58.36 3.38 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.232 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -87.31 106.99 12.8 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.407 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.407 ' HA ' ' HG2' ' A' ' 42' ' ' PRO . 38.0 Cg_endo -66.73 105.45 0.94 Allowed 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.241 1.961 . . . . 0.0 112.333 -179.639 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.45 96.82 4.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.691 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 16.1 mtmm 55.22 98.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.99 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.41 -145.88 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.596 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 18.7 m -71.13 144.43 13.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.782 0.325 . . . . 0.0 111.191 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.99 -177.94 3.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.835 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.707 ' NZ ' HG13 ' A' ' 104' ' ' VAL . 0.0 OUTLIER -58.93 95.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.846 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -67.73 -34.04 76.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.986 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 172.08 166.33 30.56 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.55 -0.834 . . . . 0.0 112.843 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.29 -2.42 12.61 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.826 2.35 . . . . 0.0 112.806 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -44.0 -28.03 0.43 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.843 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.428 ' HA ' ' CD2' ' A' ' 61' ' ' PHE . . . -45.61 -49.09 14.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.84 0.352 . . . . 0.0 111.412 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.2 p -54.0 -22.14 9.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.545 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -86.02 -31.2 22.13 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.861 0.362 . . . . 0.0 110.768 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.491 ' CA ' ' HB2' ' A' ' 65' ' ' MET . 19.0 m-30 -55.56 -30.59 61.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.743 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.583 ' HA ' ' HB2' ' A' ' 66' ' ' TRP . 0.0 OUTLIER -63.68 -14.79 55.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.549 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.7 mtpt -90.94 -68.36 0.8 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.139 0.495 . . . . 0.0 111.418 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.1 mttt -87.96 -51.49 5.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.084 -179.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.603 ' O ' ' HB3' ' A' ' 69' ' ' ALA . 2.1 mmt -63.63 -13.98 47.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.568 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' TRP . . . . . 0.583 ' HB2' ' HA ' ' A' ' 62' ' ' THR . 18.8 t90 -83.56 -34.96 25.09 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 121.392 0.615 . . . . 0.0 109.668 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -94.34 -22.99 17.99 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.118 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -114.1 -28.15 7.42 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.653 ' HB1' ' CB ' ' A' ' 95' ' ' ASP . . . -108.22 154.66 21.44 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.39 -178.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.505 ' O ' ' N ' ' A' ' 96' ' ' GLY . 0.0 OUTLIER -51.24 100.45 0.03 OUTLIER 'General case' 0 C--O 1.225 -0.188 0 CA-C-O 122.059 0.933 . . . . 0.0 108.676 -179.828 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.575 ' HB3' ' HA ' ' A' ' 66' ' ' TRP . 0.0 OUTLIER -84.97 174.41 9.79 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.312 -1.313 . . . . 0.0 114.019 -176.377 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.826 HG21 HG23 ' A' ' 92' ' ' ILE . 23.1 pt -63.96 141.05 18.69 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.21 0 CA-C-O 122.278 1.037 . . . . 0.0 113.757 -175.446 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.497 ' CG ' ' HB3' ' A' ' 11' ' ' PRO . 41.2 mt-10 -158.78 157.57 31.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 113.371 -1.741 . . . . 0.0 107.927 179.46 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.548 HG21 ' HE2' ' A' ' 9' ' ' LYS . 1.7 p -100.85 145.12 11.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.359 -0.536 . . . . 0.0 111.073 -179.257 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.412 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -125.79 -69.25 0.79 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.534 -179.197 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.412 ' CD1' ' HB3' ' A' ' 75' ' ' GLU . 12.6 p90 -138.67 156.4 47.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.947 0.403 . . . . 0.0 111.236 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.519 ' H ' HD21 ' A' ' 7' ' ' LEU . 6.3 m-20 -104.03 158.47 16.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.823 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.9 tptt -87.42 -40.72 14.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.044 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 106.02 26.46 6.04 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.573 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -118.56 -40.47 2.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.907 0.384 . . . . 0.0 110.701 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.749 ' HA ' HD22 ' A' ' 89' ' ' LEU . 0.0 OUTLIER 80.04 -54.76 0.38 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.191 179.848 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.551 HG22 ' HG3' ' A' ' 81' ' ' ARG . 1.3 t -110.04 120.61 43.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.651 0.262 . . . . 0.0 111.078 179.555 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.754 ' OD2' HD21 ' A' ' 36' ' ' LEU . 0.2 OUTLIER -115.54 -51.58 2.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.261 179.893 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.34 -63.22 1.41 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.195 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -103.51 -35.2 8.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.898 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.483 ' HA2' ' CB ' ' A' ' 82' ' ' THR . . . 108.61 51.09 0.72 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.005 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 61.5 mtt-85 -130.43 97.85 4.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.909 0.385 . . . . 0.0 111.208 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.425 ' HA3' ' O ' ' A' ' 33' ' ' THR . . . 53.01 168.38 0.02 OUTLIER Glycine 0 C--N 1.331 0.255 0 CA-C-N 115.919 -0.582 . . . . 0.0 113.136 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.749 HD22 ' HA ' ' A' ' 81' ' ' ARG . 1.0 OUTLIER -128.74 97.93 4.83 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.542 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.989 ' HB3' ' CB ' ' A' ' 34' ' ' PHE . . . -165.46 148.0 7.75 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.064 0.459 . . . . 0.0 111.659 178.178 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.662 ' N ' ' CD1' ' A' ' 91' ' ' TYR . 0.1 OUTLIER -92.5 136.96 32.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.906 -177.665 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.848 HD11 ' O ' ' A' ' 34' ' ' PHE . 2.5 mp -89.52 109.62 20.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.318 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.626 ' N ' HG22 ' A' ' 72' ' ' ILE . 3.5 m-85 -88.41 117.49 27.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.86 0.362 . . . . 0.0 110.613 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -113.47 121.26 43.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.914 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.653 ' CB ' ' HB1' ' A' ' 69' ' ' ALA . 4.6 p-10 44.78 44.56 7.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.078 0.466 . . . . 0.0 110.838 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 70' ' ' LYS . . . 52.32 18.36 4.9 Favored Glycine 0 CA--C 1.52 0.365 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.931 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -137.55 120.88 16.96 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.658 0.266 . . . . 0.0 110.759 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 2.7 mpp? -65.75 121.59 15.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.659 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 10.9 p -57.4 -34.62 46.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.094 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 61.32 103.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.982 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -135.15 118.8 17.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.816 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -166.24 135.64 3.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.236 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 32.4 mt 59.69 165.32 0.06 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.991 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.707 HG13 ' NZ ' ' A' ' 53' ' ' LYS . 21.5 t -127.81 99.53 5.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.021 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 66.77 -73.97 0.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.752 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -147.81 -47.15 0.16 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.831 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -154.5 67.72 0.31 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.519 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 14.2 tp 61.71 45.16 8.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.81 0.338 . . . . 0.0 110.791 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 60.94 85.95 0.11 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.146 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.232 -0.889 . . . . 0.0 110.91 -179.992 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.831 0.348 . . . . 0.0 111.0 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 68.1 p -101.86 125.83 48.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.861 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 44.8 t -69.28 128.6 37.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.857 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -106.5 148.38 28.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.934 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.56 138.61 48.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.903 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.1 115.11 24.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.014 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.95 HD21 ' CG ' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -84.06 151.08 25.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.72 -179.997 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.718 ' H ' HD13 ' A' ' 7' ' ' LEU . 7.3 m80 -117.81 136.56 53.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.934 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -116.94 116.25 27.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.953 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.431 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 0.4 OUTLIER -155.14 145.48 15.95 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.159 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.549 ' HB3' HG21 ' A' ' 72' ' ' ILE . 73.7 Cg_endo -78.44 141.1 17.62 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.14 1.893 . . . . 0.0 112.526 -179.533 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.839 ' O ' HD11 ' A' ' 72' ' ' ILE . . . -115.32 -165.42 1.03 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.031 -179.827 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.442 HG22 ' H ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -120.03 -168.86 1.68 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.976 0.417 . . . . 0.0 111.276 -179.501 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.442 ' H ' HG22 ' A' ' 13' ' ' THR . 0.9 OUTLIER -53.86 157.27 2.45 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.417 -179.746 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.462 ' CG2' ' HB3' ' A' ' 25' ' ' LEU . 1.2 pp -112.03 -179.12 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.089 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.76 172.97 6.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.837 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.761 ' O ' HD13 ' A' ' 18' ' ' ILE . . . -106.47 126.81 52.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.116 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.761 HD13 ' O ' ' A' ' 17' ' ' ALA . 19.7 mm -141.41 158.17 21.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.214 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.471 ' N ' HG22 ' A' ' 18' ' ' ILE . 12.9 p-10 -72.96 66.42 0.79 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.81 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 160.88 -130.55 2.39 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.361 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.525 ' O ' HG13 ' A' ' 23' ' ' VAL . 52.0 m-20 -113.09 -15.26 12.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.696 0.284 . . . . 0.0 110.887 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.548 ' OG1' HG21 ' A' ' 18' ' ' ILE . 31.1 p -54.6 109.08 0.45 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.97 0.414 . . . . 0.0 111.424 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.617 ' O ' HD23 ' A' ' 25' ' ' LEU . 35.3 m -122.73 118.89 56.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.619 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.86 106.49 16.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.492 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.663 HD11 ' CD ' ' A' ' 75' ' ' GLU . 0.3 OUTLIER -118.76 164.95 14.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.593 179.513 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 2.4 ttp -79.95 99.8 7.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.567 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.425 ' CD1' ' HB2' ' A' ' 28' ' ' LYS . 51.1 t80 -124.27 133.43 53.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.998 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.425 ' HB2' ' CD1' ' A' ' 27' ' ' TYR . 0.0 OUTLIER 57.37 28.68 15.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.93 179.988 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.54 4.91 85.48 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.941 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -136.78 143.9 44.61 Favored Pre-proline 0 C--N 1.332 -0.163 0 CA-C-N 116.737 0.269 . . . . 0.0 111.008 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.39 130.12 14.68 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.523 2.148 . . . . 0.0 112.28 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.441 ' HB2' ' CE2' ' A' ' 34' ' ' PHE . 8.3 mtt -139.67 134.24 31.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.004 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.54 129.3 35.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.834 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.774 ' CB ' ' HB2' ' A' ' 90' ' ' ALA . 60.8 m-85 -138.73 158.23 44.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.972 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.562 ' C ' ' HB3' ' A' ' 90' ' ' ALA . 16.0 ptt180 -102.43 120.86 41.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.763 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.897 HD12 HG23 ' A' ' 92' ' ' ILE . 3.3 mm? -44.57 151.52 0.27 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.239 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.471 ' O ' HD23 ' A' ' 38' ' ' LEU . 3.9 pp -59.52 138.24 57.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.029 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.471 HD23 ' O ' ' A' ' 37' ' ' LEU . 27.4 mt -133.58 168.04 19.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.803 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.454 HG12 ' N ' ' A' ' 40' ' ' ASP . 38.5 t -61.94 156.59 3.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.016 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.454 ' N ' HG12 ' A' ' 39' ' ' VAL . 40.9 m-20 -83.58 129.52 34.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.018 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.762 HG23 ' HB2' ' A' ' 49' ' ' LYS . 72.9 m -115.79 93.52 37.9 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.741 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.407 ' HB2' ' HB3' ' A' ' 46' ' ' HIS . 26.4 Cg_exo -63.38 162.96 25.17 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.734 2.29 . . . . 0.0 112.298 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -73.52 -165.17 0.24 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.857 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.516 HG22 ' HD2' ' A' ' 45' ' ' LYS . 1.1 m -70.16 151.08 45.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.023 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.516 ' HD2' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER 61.55 22.08 12.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.081 -179.966 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.459 ' CB ' ' HD2' ' A' ' 47' ' ' PRO . 1.3 m-70 -121.19 168.01 11.96 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.634 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.459 ' HD2' ' CB ' ' A' ' 46' ' ' HIS . 2.5 Cg_endo -45.66 156.2 0.43 Allowed 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.856 2.371 . . . . 0.0 112.302 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.21 152.61 0.56 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.367 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.762 ' HB2' HG23 ' A' ' 41' ' ' THR . 2.5 ptpt -103.93 -177.77 3.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.932 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -101.31 -122.64 5.04 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.483 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.477 HG12 ' N ' ' A' ' 52' ' ' GLU . 20.6 t -121.04 159.2 23.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.887 0.375 . . . . 0.0 111.066 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.477 ' N ' HG12 ' A' ' 51' ' ' VAL . 2.8 mt-10 -103.35 176.38 5.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.918 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.19 94.91 0.54 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.886 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.438 ' CE1' ' CB ' ' A' ' 57' ' ' GLU . 1.5 p90 -82.48 -26.83 32.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.073 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 152.07 -153.44 24.91 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.768 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.44 -2.87 13.11 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.666 2.244 . . . . 0.0 112.793 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.438 ' CB ' ' CE1' ' A' ' 54' ' ' TYR . 0.1 OUTLIER -50.07 -27.63 5.9 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.778 0.323 . . . . 0.0 111.042 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.51 -31.64 62.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.024 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.2 p -63.5 -28.61 70.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.956 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -55.13 -26.15 36.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.312 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -57.17 -31.53 65.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.076 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.485 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 44.6 p -87.11 -21.77 25.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.11 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.484 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 5.0 mtmt -89.18 -19.99 24.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.206 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.76 -64.26 1.17 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.779 -179.293 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 9.9 mmm -89.16 -52.97 4.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.8 -178.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' TRP . . . . . 0.485 ' HB3' ' O ' ' A' ' 62' ' ' THR . 83.5 t90 -62.11 -15.54 46.11 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.263 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.484 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 22.4 tt0 -89.57 -51.97 5.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.799 0.333 . . . . 0.0 111.15 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -80.02 -28.15 39.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.146 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -108.07 150.91 26.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.837 0.351 . . . . 0.0 111.186 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.8 mtpt -98.28 96.46 8.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.828 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.23 125.11 22.62 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.207 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.839 HD11 ' O ' ' A' ' 12' ' ' ALA . 0.3 OUTLIER -88.01 154.1 3.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.264 179.263 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -134.28 151.36 51.23 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.431 ' HB ' ' O ' ' A' ' 10' ' ' GLU . 7.5 p -126.47 153.22 34.86 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.7 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.663 ' CD ' HD11 ' A' ' 25' ' ' LEU . 2.5 mp0 -100.98 166.86 10.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.904 0.383 . . . . 0.0 111.166 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.95 ' CG ' HD21 ' A' ' 7' ' ' LEU . 6.3 m-30 -93.0 168.1 11.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.875 -179.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -96.89 91.91 5.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.715 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.706 ' HG3' HD12 ' A' ' 89' ' ' LEU . 0.1 OUTLIER -77.85 -28.14 50.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.96 -179.877 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 68.21 25.17 74.68 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.38 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.06 84.49 2.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.876 0.369 . . . . 0.0 110.587 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 61.0 ttt180 -50.95 100.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.07 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.703 HG21 ' C ' ' A' ' 87' ' ' ARG . 7.4 p -58.79 120.9 9.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.596 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -115.31 -45.44 2.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.374 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.09 -50.33 11.11 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.198 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -133.0 -35.04 1.07 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.233 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 97.73 46.87 2.21 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.815 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.703 ' C ' HG21 ' A' ' 82' ' ' THR . 21.9 mtm180 -133.47 99.16 4.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.837 0.351 . . . . 0.0 111.307 -179.44 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -85.07 -121.46 1.03 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.371 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.706 HD12 ' HG3' ' A' ' 78' ' ' LYS . 6.2 mt -128.18 128.19 44.32 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.843 0.354 . . . . 0.0 110.965 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.774 ' HB2' ' CB ' ' A' ' 34' ' ' PHE . . . -111.56 148.67 32.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.263 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.51 ' CZ ' ' CG ' ' A' ' 76' ' ' PHE . 1.6 m-85 -137.07 158.28 44.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.339 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.897 HG23 HD12 ' A' ' 36' ' ' LEU . 2.0 pp -124.85 111.75 29.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.862 0.363 . . . . 0.0 111.623 -179.721 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -98.71 134.44 41.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.602 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.47 110.84 22.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.286 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.2 t0 47.82 30.47 1.91 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.168 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.43 131.96 0.32 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.352 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 37.9 tttt -86.86 103.52 15.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.777 0.322 . . . . 0.0 110.901 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -92.35 130.32 38.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.82 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 21.4 t -88.69 149.96 3.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.091 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 18.1 p30 -121.2 174.7 6.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.91 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -131.36 -53.29 1.02 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.908 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -149.99 111.98 4.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.131 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -107.5 -31.95 7.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.9 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 3.5 m -122.51 103.36 13.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.005 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -155.32 60.47 0.63 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.916 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 69.03 -67.25 0.22 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.945 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.589 ' C ' HD12 ' A' ' 108' ' ' LEU . . . -58.26 -34.45 74.15 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.511 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.589 HD12 ' C ' ' A' ' 107' ' ' GLY . 9.2 mp -118.65 60.32 0.8 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.964 0.411 . . . . 0.0 110.822 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 62.96 144.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.137 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 2.4 tmtt? . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.842 -179.956 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.769 0.319 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.0 t -103.77 94.53 5.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.85 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.7 m -102.54 146.68 27.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.952 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.43 152.62 40.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.878 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -59.7 120.45 9.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.899 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.14 150.98 36.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.069 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.458 HD22 ' O ' ' A' ' 75' ' ' GLU . 2.9 pp -73.1 157.0 38.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.958 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 5.2 m170 -80.07 124.81 29.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.711 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 ptpt -101.09 107.73 19.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.939 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -155.14 120.84 2.62 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.796 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.414 ' N ' ' HG2' ' A' ' 73' ' ' GLU . 84.2 Cg_endo -78.72 146.81 21.4 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.299 1.999 . . . . 0.0 112.124 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.814 ' HB1' ' O ' ' A' ' 26' ' ' MET . . . -127.83 -86.78 0.57 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.347 -179.842 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.657 HG23 ' O ' ' A' ' 12' ' ' ALA . 0.1 OUTLIER 167.57 119.77 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.678 0.275 . . . . 0.0 110.991 -179.908 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.725 ' HA ' HD12 ' A' ' 25' ' ' LEU . 10.9 tp -85.8 155.84 20.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.202 179.233 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.768 HD11 ' HG3' ' A' ' 26' ' ' MET . 12.7 mt -125.2 -72.34 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.34 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -120.23 146.51 45.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.893 0.377 . . . . 0.0 111.289 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.865 ' HA ' HG12 ' A' ' 23' ' ' VAL . . . -127.1 97.94 5.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.941 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.593 HD11 ' CB ' ' A' ' 21' ' ' ASP . 5.7 pt -64.62 -164.23 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.108 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -69.14 63.4 0.13 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.644 0.259 . . . . 0.0 111.499 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 42.58 70.21 0.52 Allowed Glycine 0 CA--C 1.519 0.289 0 C-N-CA 121.23 -0.51 . . . . 0.0 113.295 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.593 ' CB ' HD11 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -147.09 -39.57 0.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.592 0.234 . . . . 0.0 111.128 179.818 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.7 t -169.5 120.74 0.7 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.867 0.365 . . . . 0.0 111.144 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.865 HG12 ' HA ' ' A' ' 17' ' ' ALA . 33.6 m -117.66 131.73 69.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.885 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.403 ' HB3' ' HB ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -79.13 147.35 32.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.924 0.392 . . . . 0.0 111.209 -179.572 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.725 HD12 ' HA ' ' A' ' 14' ' ' LEU . 2.1 tp -141.01 125.37 17.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.82 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.814 ' O ' ' HB1' ' A' ' 12' ' ' ALA . 7.7 mtt -72.92 99.82 2.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.821 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -125.67 126.94 45.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.965 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.53 33.23 20.65 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.085 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.21 20.67 73.35 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.457 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.412 ' HA ' ' HD3' ' A' ' 31' ' ' PRO . 8.3 mt-30 -134.66 119.71 14.08 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.542 0.21 . . . . 0.0 110.84 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 30' ' ' GLN . 34.1 Cg_exo -59.72 133.52 51.77 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.401 2.067 . . . . 0.0 112.431 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.608 ' HB3' ' CE2' ' A' ' 34' ' ' PHE . 15.2 mmt -132.33 110.16 10.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.155 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.602 HG23 ' O ' ' A' ' 33' ' ' THR . 8.8 t -120.69 86.3 2.55 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -179.125 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.608 ' CE2' ' HB3' ' A' ' 32' ' ' MET . 1.7 p90 -142.09 106.26 4.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.438 177.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.641 ' HG3' ' HB1' ' A' ' 90' ' ' ALA . 13.4 ttp180 -140.55 97.08 3.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.634 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.926 HD11 ' HA2' ' A' ' 88' ' ' GLY . 0.5 OUTLIER -142.54 88.78 2.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.894 0.378 . . . . 0.0 110.75 178.971 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.732 ' C ' HD13 ' A' ' 38' ' ' LEU . 0.9 OUTLIER -133.03 93.73 3.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.794 180.0 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.732 HD13 ' C ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -148.48 177.05 9.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.841 179.902 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 16.1 m -93.92 144.42 9.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.165 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -105.43 128.48 53.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.906 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.617 HG21 ' HG3' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -105.34 147.78 35.16 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.859 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -72.06 147.8 49.46 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.643 2.228 . . . . 0.0 112.288 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -103.01 32.99 3.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.886 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -106.78 113.28 26.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.9 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 68.99 -67.37 0.22 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.046 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 42.9 m-70 -84.01 143.14 42.4 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.929 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.07 155.97 42.65 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.614 2.209 . . . . 0.0 112.356 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.0 152.04 45.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.835 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.617 ' HG3' HG21 ' A' ' 41' ' ' THR . 0.0 OUTLIER -155.55 29.4 0.38 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.025 -179.979 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -105.25 -53.32 0.79 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.49 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.8 t -101.63 85.81 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.776 0.322 . . . . 0.0 111.133 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.0 150.96 26.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.894 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.56 94.61 0.43 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.857 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -56.22 -34.09 65.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.996 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 69.62 -147.64 45.58 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.635 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -54.19 -21.97 24.24 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.634 2.222 . . . . 0.0 112.603 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -54.18 -54.4 40.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.23 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.52 -52.23 66.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.249 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.3 m -62.35 -30.8 71.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.089 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.62 -30.47 71.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.232 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 35.3 t80 -71.97 -42.07 66.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.041 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.432 ' CA ' ' HB3' ' A' ' 66' ' ' TRP . 81.1 p -76.11 -48.82 19.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.928 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.473 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -53.8 -21.33 7.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.442 -179.949 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.51 -60.86 1.85 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.301 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.491 ' O ' ' HB3' ' A' ' 69' ' ' ALA . 18.9 mtm -90.12 -51.97 5.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.91 -179.145 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' TRP . . . . . 0.652 ' CE2' HD23 ' A' ' 14' ' ' LEU . 64.3 t90 -59.99 -33.0 71.38 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -178.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.473 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -74.44 -50.19 19.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.741 0.305 . . . . 0.0 111.659 -179.365 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -79.8 -28.67 40.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.429 -179.414 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 65' ' ' MET . . . -108.47 148.5 30.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.224 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.9 mmmm -104.25 92.81 4.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.45 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -140.4 98.81 3.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.974 -179.776 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.671 HD13 ' N ' ' A' ' 72' ' ' ILE . 0.0 OUTLIER -139.66 131.44 33.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.18 0.514 . . . . 0.0 111.767 179.883 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.415 ' HB2' ' CG ' ' A' ' 93' ' ' TYR . 0.2 OUTLIER -165.18 178.97 6.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.014 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.7 t -100.9 136.36 32.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.756 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.458 ' O ' HD22 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -130.84 -5.91 4.02 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -179.363 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.687 ' HB2' HD23 ' A' ' 89' ' ' LEU . 2.7 p90 -92.14 137.86 32.01 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.129 0.49 . . . . 0.0 111.771 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.506 ' C ' HD22 ' A' ' 89' ' ' LEU . 9.2 p-10 -104.58 91.83 4.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.229 179.049 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.485 ' HA ' HD13 ' A' ' 89' ' ' LEU . 1.8 tptp -78.41 -71.93 0.4 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.193 -179.405 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 95.62 -27.74 14.77 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.244 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.9 -163.35 0.47 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.622 0.248 . . . . 0.0 110.568 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -119.1 18.27 13.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.474 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 16.4 p -109.07 120.04 41.34 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.909 0.385 . . . . 0.0 111.011 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.555 ' O ' ' HB3' ' A' ' 87' ' ' ARG . 4.7 m-20 -116.92 -52.15 2.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.316 0.579 . . . . 0.0 109.665 178.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 4.5 mtpt -111.19 -32.94 6.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.675 178.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 46.0 m-85 -87.69 46.48 1.38 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.884 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 130.44 44.04 0.18 Allowed Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.951 -0.642 . . . . 0.0 111.57 -179.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.555 ' HB3' ' O ' ' A' ' 83' ' ' ASP . 0.0 OUTLIER -57.8 132.97 54.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.137 0.494 . . . . 0.0 110.229 179.394 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.926 ' HA2' HD11 ' A' ' 36' ' ' LEU . . . -129.92 -35.72 0.42 Allowed Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.703 -0.761 . . . . 0.0 113.538 -179.323 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.687 HD23 ' HB2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER -103.46 148.47 25.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.819 0.342 . . . . 0.0 111.554 -179.14 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.78 ' HB2' ' N ' ' A' ' 36' ' ' LEU . . . -118.62 147.19 44.0 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.435 0.532 . . . . 0.0 112.435 -179.105 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -116.04 144.99 43.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.016 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.568 HG23 ' O ' ' A' ' 92' ' ' ILE . 1.3 tt -150.11 113.57 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.84 179.603 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.415 ' CG ' ' HB2' ' A' ' 73' ' ' GLU . 7.8 t80 -108.07 123.44 48.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.069 0.462 . . . . 0.0 111.156 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.712 ' HB3' ' HA ' ' A' ' 98' ' ' MET . . . -134.18 91.8 2.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.158 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 38.4 t70 50.39 58.07 5.9 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.484 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 80.64 -61.64 4.46 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.764 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 4.5 mtpm? -111.83 121.92 46.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.888 0.375 . . . . 0.0 110.942 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' MET . . . . . 0.712 ' HA ' ' HB3' ' A' ' 94' ' ' ALA . 1.4 ptt? -72.28 110.04 6.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.733 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 29.3 m -127.58 127.57 68.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.249 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -90.87 -51.42 5.36 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.88 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -114.28 112.26 22.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.869 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.27 129.07 37.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.195 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 mp -127.05 164.9 20.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.887 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.5 t 61.47 96.25 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.024 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -135.74 -65.27 0.6 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.931 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -94.39 -34.33 12.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.943 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 115.16 36.08 1.26 Allowed Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.46 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.8 tp -84.31 -30.26 25.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.838 0.351 . . . . 0.0 110.979 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 61.67 162.3 0.07 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.168 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.842 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.299 0 CA-C-O 120.75 0.309 . . . . 0.0 111.118 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -104.63 101.55 11.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.791 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 25.8 t -65.81 129.03 38.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.915 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 64.0 p -91.54 144.54 25.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.939 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 31.8 mmtt -63.71 132.93 52.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.943 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -93.27 123.13 36.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.93 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.605 HD22 ' C ' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -70.05 157.13 38.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.93 -179.863 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -79.71 155.04 28.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.707 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.79 132.17 39.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.185 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.436 ' O ' HG23 ' A' ' 74' ' ' VAL . 7.1 tt0 -155.03 120.13 2.59 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.767 179.874 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -80.27 170.96 15.57 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.507 2.138 . . . . 0.0 112.685 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 1.065 ' HB3' HD23 ' A' ' 25' ' ' LEU . . . -136.57 -80.3 0.4 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.742 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.953 HG23 HD13 ' A' ' 72' ' ' ILE . 3.8 m 90.43 -69.36 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.651 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.49 87.02 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.818 0.342 . . . . 0.0 111.272 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.766 HG22 ' HA ' ' A' ' 25' ' ' LEU . 2.6 pp -125.48 -179.1 2.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.114 0.483 . . . . 0.0 111.726 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.9 mtpt -133.31 173.01 11.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.26 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -93.87 130.27 39.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.873 0.368 . . . . 0.0 111.255 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.616 HG21 ' CG2' ' A' ' 22' ' ' THR . 3.5 mp -140.34 157.98 25.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.974 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.462 ' N ' HG22 ' A' ' 18' ' ' ILE . 0.3 OUTLIER -98.03 146.52 25.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.975 -179.939 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.18 -129.95 10.11 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.519 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -126.16 89.32 3.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.728 0.299 . . . . 0.0 110.858 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.616 ' CG2' HG21 ' A' ' 18' ' ' ILE . 8.8 t -174.15 136.4 0.5 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.048 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.7 m -142.32 117.98 5.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.128 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.733 ' O ' HG22 ' A' ' 15' ' ' ILE . 1.4 tttp -79.68 97.68 6.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.444 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 1.065 HD23 ' HB3' ' A' ' 12' ' ' ALA . 0.4 OUTLIER -97.7 145.36 26.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.363 179.277 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.767 ' N ' ' HB1' ' A' ' 12' ' ' ALA . 14.2 ttt -72.86 99.32 2.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.922 0.392 . . . . 0.0 110.718 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -105.11 94.93 5.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.855 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 65.1 tttt 53.99 29.95 10.94 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.982 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 82.47 22.01 59.25 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.585 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -124.67 122.37 25.72 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-O 120.484 0.183 . . . . 0.0 110.753 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.61 127.53 23.97 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.416 2.077 . . . . 0.0 112.394 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.519 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 1.4 ptm -139.55 110.11 6.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.586 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.523 HG23 ' N ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -114.84 94.37 4.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.891 0.377 . . . . 0.0 111.51 -179.653 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 1.067 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 2.2 m-85 -141.14 143.34 34.21 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.11 0.481 . . . . 0.0 110.133 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.438 ' HA ' ' O ' ' A' ' 90' ' ' ALA . 6.3 ttt180 -143.63 98.12 3.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.013 -0.54 . . . . 0.0 112.063 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.635 HD22 HD22 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -142.72 88.68 2.08 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.318 178.91 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.671 ' O ' HD12 ' A' ' 37' ' ' LEU . 1.1 pp -125.89 84.04 2.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.783 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -133.12 122.8 24.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.843 -179.743 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 10.4 p -138.67 141.88 36.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.025 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -100.51 128.47 46.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.869 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 90.7 m -103.68 93.95 5.66 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.919 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.64 158.29 53.86 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.471 2.114 . . . . 0.0 112.206 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -177.7 125.46 0.13 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.883 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.71 119.57 24.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.948 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.9 2.56 4.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.721 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.451 ' CG ' ' HD2' ' A' ' 47' ' ' PRO . 0.3 OUTLIER -121.33 145.8 43.23 Favored Pre-proline 0 C--N 1.332 -0.191 0 CA-C-O 120.605 0.24 . . . . 0.0 110.982 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.451 ' HD2' ' CG ' ' A' ' 46' ' ' HIS . 56.0 Cg_endo -69.97 127.92 15.1 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.541 2.161 . . . . 0.0 112.205 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.7 pttm -58.83 143.98 45.73 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.927 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -124.56 45.05 2.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.867 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -60.75 -162.5 0.14 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.522 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.526 ' O ' HG13 ' A' ' 51' ' ' VAL . 11.6 p -78.84 117.78 25.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.717 0.294 . . . . 0.0 111.116 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -108.14 169.42 8.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.96 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.6 mtmm -84.56 93.44 8.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.918 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.46 ' HB3' ' CD1' ' A' ' 61' ' ' PHE . 12.3 m-85 -79.65 -33.6 41.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.965 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.534 ' N ' ' HB2' ' A' ' 61' ' ' PHE . . . -57.59 138.51 48.12 Favored Glycine 0 CA--C 1.508 -0.366 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.169 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.609 ' HD2' ' CB ' ' A' ' 60' ' ' ALA . 94.4 Cg_exo -38.29 -59.27 0.58 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 121.686 1.591 . . . . 0.0 112.843 -177.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -101.17 -78.05 0.53 Allowed 'General case' 0 C--N 1.348 0.508 0 C-N-CA 117.484 -1.686 . . . . 0.0 111.651 176.047 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -104.31 -74.74 0.64 Allowed 'General case' 0 C--N 1.346 0.415 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 176.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.546 ' O ' ' N ' ' A' ' 61' ' ' PHE . 89.4 p -100.59 -14.75 18.05 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 113.009 -1.905 . . . . 0.0 114.141 -178.838 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.609 ' CB ' ' HD2' ' A' ' 56' ' ' PRO . . . -37.0 -16.2 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -175.318 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.546 ' N ' ' O ' ' A' ' 59' ' ' SER . 5.6 t80 -52.63 -42.4 64.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 118.416 0.553 . . . . 0.0 111.379 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.446 ' HA ' ' HB2' ' A' ' 66' ' ' TRP . 32.9 p -82.38 -43.14 17.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.85 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.05 -20.12 15.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.507 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 44.8 mmtt -86.84 -63.73 1.26 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.768 0.318 . . . . 0.0 111.187 -179.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 2.8 ttp -89.27 -55.31 3.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.197 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' TRP . . . . . 0.861 ' CZ2' HG23 ' A' ' 72' ' ' ILE . 0.6 OUTLIER -51.4 -26.64 8.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.57 -179.738 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -94.06 -36.77 11.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.44 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -79.98 -28.15 39.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.347 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.649 ' HB3' ' HD3' ' A' ' 71' ' ' LYS . . . -108.3 150.97 26.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.094 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.31 92.96 9.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.009 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.649 ' HD3' ' HB3' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -160.35 98.86 1.29 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.923 179.936 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.953 HD13 HG23 ' A' ' 13' ' ' THR . 1.6 mp -136.05 130.96 49.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.963 0.411 . . . . 0.0 111.462 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -151.76 157.0 41.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.671 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.981 HG13 HD22 ' A' ' 25' ' ' LEU . 0.6 OUTLIER -136.17 153.08 31.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.933 0.397 . . . . 0.0 111.194 -179.987 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.584 ' HA ' HD11 ' A' ' 7' ' ' LEU . 1.8 mt-10 -163.55 78.66 0.42 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.701 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.605 ' C ' HD22 ' A' ' 7' ' ' LEU . 26.3 p90 -142.7 158.86 43.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.148 0.499 . . . . 0.0 111.523 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.23 162.76 4.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.411 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 67.3 mttt -50.55 -26.88 5.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.243 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.2 40.97 54.85 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.813 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -91.32 51.0 1.83 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.956 0.408 . . . . 0.0 110.799 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -122.68 -39.19 2.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.123 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.838 HG21 ' O ' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -59.44 122.2 13.39 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.078 0.466 . . . . 0.0 111.047 -179.827 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -115.46 -47.76 2.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.86 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.61 -61.06 2.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.113 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -80.97 -35.47 32.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.155 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.76 25.59 52.7 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.082 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.838 ' O ' HG21 ' A' ' 82' ' ' THR . 4.3 mtp85 -131.97 107.07 8.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.849 0.356 . . . . 0.0 110.645 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.472 ' O ' ' O ' ' A' ' 87' ' ' ARG . . . -54.29 -150.71 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.228 0 CA-C-N 115.736 -0.665 . . . . 0.0 113.125 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.635 HD22 HD22 ' A' ' 36' ' ' LEU . 0.5 OUTLIER -128.32 132.92 48.62 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 122.778 -0.248 . . . . 0.0 111.377 -179.223 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 1.067 ' HB3' ' O ' ' A' ' 34' ' ' PHE . . . -128.76 154.84 45.98 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 120.35 -0.54 . . . . 0.0 112.134 178.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.468 ' CD1' ' O ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -117.8 127.12 53.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.81 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 8.6 pt -79.9 130.85 35.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.129 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -117.58 117.93 30.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.836 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.41 104.58 16.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.051 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.404 ' CA ' ' HB2' ' A' ' 71' ' ' LYS . 0.4 OUTLIER 64.63 36.31 8.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.946 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 53.82 97.61 0.01 OUTLIER Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.625 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -91.09 102.27 15.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.826 0.346 . . . . 0.0 110.961 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.08 116.59 31.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.836 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 21.0 t 68.61 -68.0 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.173 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -131.18 -177.12 4.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.959 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -112.27 31.48 6.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.9 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -110.54 -167.88 1.24 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.201 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 11.0 tp 63.08 144.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.917 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.5 t 63.36 81.48 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.066 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.62 -44.88 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.903 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -114.44 32.75 5.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.842 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -166.12 -74.41 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.505 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.1 tp -64.43 -32.5 74.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.803 0.335 . . . . 0.0 110.824 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -63.66 97.37 0.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.99 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.315 -0.85 . . . . 0.0 110.893 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.81 0.338 . . . . 0.0 110.997 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.28 125.37 53.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.881 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.5 m -104.97 134.6 47.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.996 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 26.0 m -69.55 121.35 16.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.881 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.6 mtmm -72.67 146.49 46.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.994 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.72 149.27 47.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.74 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.5 mt -120.02 113.78 21.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.313 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 40.2 m-70 -71.59 99.9 2.17 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.38 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.813 ' HG3' HG23 ' A' ' 74' ' ' VAL . 5.7 mmtp -118.3 158.82 24.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.355 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -104.22 164.68 14.81 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.232 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.417 ' HA ' ' O ' ' A' ' 72' ' ' ILE . 86.6 Cg_endo -78.03 106.11 2.11 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.31 2.006 . . . . 0.0 112.857 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.513 ' O ' ' OG1' ' A' ' 13' ' ' THR . . . -158.19 124.5 4.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.389 179.726 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.711 ' HA ' ' HB3' ' A' ' 25' ' ' LEU . 76.1 m -176.31 24.88 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.888 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.535 ' O ' HD13 ' A' ' 15' ' ' ILE . 0.7 OUTLIER -98.09 83.81 3.17 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.013 -0.675 . . . . 0.0 110.06 178.983 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.535 HD13 ' O ' ' A' ' 14' ' ' LEU . 2.1 mm -127.63 -70.88 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.395 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt -145.61 140.98 27.76 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.933 179.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.86 133.84 39.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.966 0.413 . . . . 0.0 111.622 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.482 HG22 ' N ' ' A' ' 19' ' ' ASP . 16.5 mt -153.16 159.31 3.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.781 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.482 ' N ' HG22 ' A' ' 18' ' ' ILE . 0.5 OUTLIER -67.76 172.25 5.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.864 0.364 . . . . 0.0 111.042 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.466 ' CA ' ' HB2' ' A' ' 36' ' ' LEU . . . -69.73 65.85 0.63 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.835 -0.697 . . . . 0.0 112.472 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -148.18 -52.16 0.18 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.041 0.448 . . . . 0.0 110.143 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.477 HG23 HG21 ' A' ' 18' ' ' ILE . 0.7 OUTLIER -143.19 106.48 4.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.818 179.768 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.475 HG22 ' HB ' ' A' ' 18' ' ' ILE . 23.2 t -130.78 128.09 62.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.324 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.449 ' C ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -92.59 144.35 25.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.183 0.516 . . . . 0.0 111.944 -179.093 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.897 HD11 ' CE1' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -132.28 165.33 24.42 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.986 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.436 ' N ' HD11 ' A' ' 15' ' ' ILE . 6.7 mtt -77.18 98.62 5.15 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.446 ' HB2' HD23 ' A' ' 25' ' ' LEU . 5.6 t80 -128.17 113.94 16.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.074 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 52.01 26.25 3.63 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.95 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.31 13.82 76.92 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.779 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -124.86 140.88 36.73 Favored Pre-proline 0 C--N 1.332 -0.16 0 CA-C-O 120.666 0.27 . . . . 0.0 111.024 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -68.16 135.78 35.56 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.481 2.12 . . . . 0.0 111.973 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.741 ' SD ' HD21 ' A' ' 89' ' ' LEU . 2.5 mmt -145.11 110.46 5.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.244 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.715 ' O ' HD23 ' A' ' 89' ' ' LEU . 61.9 p -77.02 131.04 38.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.16 0.505 . . . . 0.0 112.277 -179.541 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.897 ' CE1' HD11 ' A' ' 25' ' ' LEU . 2.3 m-30 -106.57 158.73 16.71 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.976 179.461 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -115.64 148.08 40.07 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.348 179.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.682 HD12 ' OD1' ' A' ' 100' ' ' ASN . 0.1 OUTLIER -104.45 134.64 47.3 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.088 0.47 . . . . 0.0 111.682 -179.364 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.8 tp -144.25 133.74 23.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.618 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -96.58 148.56 22.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.812 0.339 . . . . 0.0 111.053 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.7 t -67.29 112.88 2.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.149 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -67.48 159.87 28.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.974 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.5 m -89.32 107.45 18.31 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.913 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -68.37 146.73 69.8 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.469 2.113 . . . . 0.0 112.326 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -130.85 173.84 10.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.823 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -78.92 100.78 7.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.834 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? 57.87 21.18 7.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.141 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -121.21 156.6 57.23 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.935 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.42 118.47 5.08 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.6 2.2 . . . . 0.0 112.236 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.2 pptp? -69.91 116.73 10.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.007 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -174.03 164.3 4.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.888 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -159.67 -163.48 13.44 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.416 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 29.7 m -71.2 140.13 18.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.694 0.283 . . . . 0.0 111.09 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.1 118.62 37.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.784 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -57.82 93.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.86 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -92.97 36.06 1.04 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.161 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -104.63 158.43 16.4 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.415 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.87 -15.64 36.78 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.571 2.181 . . . . 0.0 112.463 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.8 pm0 -55.87 -27.36 51.35 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.858 0.361 . . . . 0.0 111.217 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.442 ' HB3' ' HG3' ' A' ' 101' ' ' GLU . . . -58.31 -65.06 0.71 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.135 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.35 -38.54 89.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.832 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.51 -32.07 73.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.016 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.403 ' CZ ' ' HB3' ' A' ' 94' ' ' ALA . 0.2 OUTLIER -59.34 -51.78 68.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.641 179.905 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.441 ' HB ' ' HB3' ' A' ' 66' ' ' TRP . 51.4 p -58.2 -45.54 87.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.783 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.402 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 1.9 tttm -54.92 -19.83 7.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.34 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.19 -63.38 1.31 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.935 0.398 . . . . 0.0 111.204 -179.73 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.5 ' O ' ' N ' ' A' ' 69' ' ' ALA . 2.1 mtt -87.93 -58.87 2.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.223 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' TRP . . . . . 0.441 ' HB3' ' HB ' ' A' ' 62' ' ' THR . 74.9 t90 -51.55 -32.0 26.54 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.402 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 0.5 OUTLIER -94.44 -52.66 4.23 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -179.168 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -79.47 -28.29 41.54 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.746 0.308 . . . . 0.0 111.625 -178.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 65' ' ' MET . . . -107.69 151.21 25.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.597 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.2 mtmt -103.41 97.25 7.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.844 0.354 . . . . 0.0 111.94 -178.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.455 ' HD3' ' CB ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -166.25 96.63 0.59 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.712 178.79 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.634 HG21 ' CB ' ' A' ' 13' ' ' THR . 1.3 mp -141.47 103.83 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.148 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -136.84 151.43 49.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.845 0.355 . . . . 0.0 111.796 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.813 HG23 ' HG3' ' A' ' 9' ' ' LYS . 2.0 m -103.81 153.63 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.793 -179.556 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.56 -75.41 0.61 Allowed 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.989 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -143.39 146.33 33.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.852 0.358 . . . . 0.0 111.007 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.909 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 1.9 p30 -59.12 148.29 31.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.093 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.411 ' NZ ' ' HB2' ' A' ' 80' ' ' GLN . 0.2 OUTLIER -101.2 -61.35 1.38 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.835 179.872 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 100.89 41.17 2.71 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.884 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.411 ' HB2' ' NZ ' ' A' ' 78' ' ' LYS . 2.8 mt-30 -123.97 150.77 44.41 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.855 0.36 . . . . 0.0 110.922 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 69.1 9.97 7.64 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.24 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.473 ' CB ' ' O ' ' A' ' 85' ' ' TYR . 0.5 OUTLIER -109.3 148.42 31.06 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.658 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -84.69 -52.57 5.98 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.073 0.463 . . . . 0.0 110.079 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.9 mttt -110.51 -57.29 2.24 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 177.065 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.737 ' O ' ' N ' ' A' ' 87' ' ' ARG . 65.9 m-85 -133.35 -37.7 0.95 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 113.879 -1.51 . . . . 0.0 107.985 176.22 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.454 ' HA3' ' HB ' ' A' ' 82' ' ' THR . . . 44.28 -36.71 0.0 OUTLIER Glycine 0 N--CA 1.472 1.086 0 C-N-CA 125.188 1.375 . . . . 0.0 115.662 177.685 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.737 ' N ' ' O ' ' A' ' 85' ' ' TYR . 0.1 OUTLIER -142.69 95.88 2.85 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 176.912 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.813 ' C ' HD13 ' A' ' 89' ' ' LEU . . . -77.42 13.03 12.04 Favored Glycine 0 C--N 1.313 -0.75 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.179 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.813 HD13 ' C ' ' A' ' 88' ' ' GLY . 0.0 OUTLIER -128.2 149.81 50.29 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 122.787 0.435 . . . . 0.0 110.229 -179.17 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.909 ' HB2' ' HA ' ' A' ' 77' ' ' ASP . . . -101.49 -178.31 3.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.023 0.44 . . . . 0.0 111.861 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.55 ' HB3' ' HA ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -71.97 145.69 48.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.834 -178.991 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.67 ' O ' HD12 ' A' ' 92' ' ' ILE . 1.3 pp -96.55 160.31 2.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.99 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -110.91 119.13 38.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.013 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.403 ' HB3' ' CZ ' ' A' ' 61' ' ' PHE . . . -97.44 93.74 6.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.082 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.416 ' N ' ' HG3' ' A' ' 71' ' ' LYS . 12.3 t0 67.05 52.46 0.87 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.873 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 105.37 -81.99 0.33 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.598 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.71 135.99 53.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.821 0.343 . . . . 0.0 111.087 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.06 139.8 34.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.855 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.441 HG12 ' N ' ' A' ' 100' ' ' ASN . 22.0 t -82.14 156.02 4.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.141 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.682 ' OD1' HD12 ' A' ' 36' ' ' LEU . 0.8 OUTLIER -95.87 167.48 11.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.882 179.936 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.442 ' HG3' ' HB3' ' A' ' 58' ' ' ALA . 0.3 OUTLIER -177.42 154.43 1.0 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.804 179.997 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -128.88 35.22 4.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.157 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 59.33 28.03 17.26 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.998 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 23.5 t 68.32 -67.66 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.273 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 3.9 ttt-85 62.16 33.24 16.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.002 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -173.56 80.88 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.902 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 155.32 -28.12 0.62 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.522 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 20.6 mt -108.72 -54.43 2.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.832 0.349 . . . . 0.0 110.861 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -108.78 -170.49 1.67 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.034 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.884 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.693 0.283 . . . . 0.0 111.024 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 66.5 p -108.86 103.14 12.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.827 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.7 t -105.44 106.81 17.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.949 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.1 p -110.37 135.14 51.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.961 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.93 144.59 54.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.869 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.7 mtpt -114.53 119.83 38.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.913 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.665 HD13 ' H ' ' A' ' 8' ' ' HIS . 0.2 OUTLIER -108.07 153.98 22.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.827 179.812 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.665 ' H ' HD13 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -93.48 147.24 23.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.864 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.27 122.76 21.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.103 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -146.11 131.64 9.28 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.514 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.568 ' HA ' ' HA ' ' A' ' 73' ' ' GLU . 84.8 Cg_endo -79.75 171.13 16.0 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.293 1.995 . . . . 0.0 112.732 -179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -153.65 -136.18 0.06 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.717 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.788 HG22 ' HB2' ' A' ' 26' ' ' MET . 3.5 t -162.24 178.44 8.73 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.743 0.306 . . . . 0.0 110.799 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.645 HD13 ' N ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -97.16 94.82 7.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.988 0.423 . . . . 0.0 111.076 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.9 mt -85.84 -68.63 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.007 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.418 ' HB2' ' CG ' ' A' ' 24' ' ' LYS . 4.4 ttpp -110.05 169.74 8.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.472 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -87.12 148.31 25.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.049 0.452 . . . . 0.0 111.85 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.883 HD11 ' HG3' ' A' ' 35' ' ' ARG . 5.9 tp -111.35 119.04 58.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.156 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -118.24 28.93 8.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.835 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.38 38.17 29.65 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.345 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -147.12 -49.47 0.19 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.747 0.308 . . . . 0.0 110.834 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 71.8 p -157.97 139.58 13.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.17 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.767 ' HB ' HD13 ' A' ' 18' ' ' ILE . 12.5 p -142.43 114.05 3.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.693 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.418 ' CG ' ' HB2' ' A' ' 16' ' ' LYS . 4.4 ptpt -91.02 125.98 35.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.386 -179.626 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 21.6 mt -124.49 157.0 36.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.606 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.788 ' HB2' HG22 ' A' ' 13' ' ' THR . 0.0 OUTLIER -72.99 99.89 2.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.905 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.615 ' CD2' HG21 ' A' ' 74' ' ' VAL . 24.9 t80 -124.37 108.47 12.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.705 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 62.7 23.75 14.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.036 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 89.96 -14.14 62.73 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.92 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -110.66 144.82 31.03 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.838 0.319 . . . . 0.0 111.089 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -73.6 151.65 47.27 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.513 2.142 . . . . 0.0 112.199 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.456 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 1.7 mmm -145.15 113.77 6.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.093 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 37.2 p -89.81 86.68 6.72 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.411 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.457 ' HB2' ' O ' ' A' ' 88' ' ' GLY . 1.9 p90 -141.31 118.76 11.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.071 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.883 ' HG3' HD11 ' A' ' 18' ' ' ILE . 0.0 OUTLIER -139.89 120.27 13.98 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.347 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.736 HD13 HD13 ' A' ' 89' ' ' LEU . 0.4 OUTLIER -143.11 146.51 33.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.12 178.201 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.452 ' O ' HG22 ' A' ' 39' ' ' VAL . 0.5 OUTLIER -144.17 135.08 25.21 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.935 0.398 . . . . 0.0 111.27 -179.932 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.7 tt -59.3 96.94 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.772 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.452 HG22 ' O ' ' A' ' 37' ' ' LEU . 5.2 m -126.91 122.07 59.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.182 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -135.45 130.36 34.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.852 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 34.5 m -106.26 121.92 43.87 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.859 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -56.15 137.0 78.06 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.489 2.126 . . . . 0.0 112.252 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 177.36 -169.42 0.07 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.608 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 30.6 p -60.91 140.16 57.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.433 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.42 ' O ' ' HD3' ' A' ' 47' ' ' PRO . 0.1 OUTLIER 62.54 -160.1 0.31 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -179.664 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -110.45 80.6 2.05 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 120.793 0.33 . . . . 0.0 111.186 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.42 ' HD3' ' O ' ' A' ' 45' ' ' LYS . 89.3 Cg_endo -84.3 155.6 12.62 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.732 2.288 . . . . 0.0 112.342 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 mttt -128.14 96.83 4.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.712 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -162.4 155.88 20.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.887 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -176.83 32.14 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.507 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.634 ' O ' HG13 ' A' ' 51' ' ' VAL . 7.7 p -121.17 83.37 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.908 0.385 . . . . 0.0 110.997 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -96.37 139.78 32.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.849 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.62 90.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.836 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.687 ' HE1' ' HB2' ' A' ' 58' ' ' ALA . 0.1 OUTLIER -130.74 26.07 5.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.189 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 75.03 -147.31 36.19 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.852 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.1 -2.67 12.63 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.86 2.374 . . . . 0.0 113.012 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -43.81 -30.65 0.69 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.84 0.352 . . . . 0.0 111.593 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.687 ' HB2' ' HE1' ' A' ' 54' ' ' TYR . . . -73.88 -60.9 2.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.966 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.6 p -62.07 -19.11 62.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.123 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -51.3 -29.06 13.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.771 0.32 . . . . 0.0 111.418 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -60.18 -63.87 1.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.809 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.447 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 0.6 OUTLIER -66.92 -34.79 78.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.749 -179.978 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.418 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 13.2 mttm -51.15 -19.85 1.31 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.627 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -81.02 -61.85 1.84 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.83 0.347 . . . . 0.0 111.013 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.443 ' O ' ' N ' ' A' ' 69' ' ' ALA . 5.7 mmt -88.68 -52.56 5.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.964 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' TRP . . . . . 0.447 ' HB3' ' O ' ' A' ' 62' ' ' THR . 68.2 t90 -53.66 -27.37 27.07 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.69 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.418 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -94.51 -56.42 2.81 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.315 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -79.88 -28.4 39.91 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 65' ' ' MET . . . -104.59 144.08 32.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.826 0.346 . . . . 0.0 110.866 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -96.59 92.6 6.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.153 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.464 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -162.06 98.11 1.05 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.015 179.536 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 2.7 mp -139.54 133.09 37.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.166 0.507 . . . . 0.0 111.96 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.589 ' HB2' ' CG ' ' A' ' 93' ' ' TYR . 10.3 mt-10 -146.7 170.09 17.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.353 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.615 HG21 ' CD2' ' A' ' 27' ' ' TYR . 27.2 m -108.14 131.99 57.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.977 0.417 . . . . 0.0 111.546 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -91.49 -164.33 1.16 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.845 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.3 p90 -92.89 136.39 33.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.056 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.635 ' HA ' ' HB3' ' A' ' 90' ' ' ALA . 36.6 p30 -103.94 162.0 13.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.044 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.0 ttmt -58.92 -66.45 0.5 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.946 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 91.23 27.72 17.35 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.588 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -129.0 -54.35 1.21 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.836 0.35 . . . . 0.0 110.984 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.87 97.9 9.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.83 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.489 ' HB ' ' HA2' ' A' ' 86' ' ' GLY . 1.6 p -83.49 171.04 13.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.726 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -115.23 -51.79 2.7 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 44.3 tttm -110.83 -64.34 1.29 Allowed 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -179.35 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -133.77 2.45 3.43 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.175 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.489 ' HA2' ' HB ' ' A' ' 82' ' ' THR . . . 128.15 51.01 0.14 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.307 -0.949 . . . . 0.0 112.601 -179.599 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 4.2 mtp85 -104.51 98.76 8.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.707 0.289 . . . . 0.0 110.991 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.457 ' O ' ' HB2' ' A' ' 34' ' ' PHE . . . -54.16 108.91 0.97 Allowed Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 178.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.736 HD13 HD13 ' A' ' 36' ' ' LEU . 0.2 OUTLIER -77.21 96.47 4.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.423 0.63 . . . . 0.0 112.63 -177.588 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.635 ' HB3' ' HA ' ' A' ' 77' ' ' ASP . . . -174.78 113.66 0.15 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.145 177.299 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.745 ' CD2' HG11 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -145.67 102.93 3.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.527 179.993 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.621 HD13 ' O ' ' A' ' 91' ' ' TYR . 32.1 mm -150.04 107.7 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.181 178.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.589 ' CG ' ' HB2' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -153.24 135.43 14.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.036 178.848 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -134.42 99.75 4.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.875 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.459 ' CA ' ' HB2' ' A' ' 71' ' ' LYS . 4.4 t0 57.89 41.55 24.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.822 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.78 42.0 99.32 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.493 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.82 100.58 10.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.849 0.357 . . . . 0.0 110.881 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.72 145.6 24.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.847 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 11.2 p -60.45 -31.91 49.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.992 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -139.61 164.51 29.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.937 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -104.23 132.53 50.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.921 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -114.53 -57.95 2.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.099 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 3.1 pp -111.04 161.18 16.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.924 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 6.5 m -134.84 167.6 25.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.182 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 70.5 mtt85 -101.1 160.22 14.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.861 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -98.75 147.73 24.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.888 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.9 -79.51 1.84 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.455 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.459 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 2.0 mm? -69.46 -22.51 63.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.771 0.319 . . . . 0.0 111.086 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.459 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . 70.37 -64.8 0.35 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.12 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.166 -0.921 . . . . 0.0 110.846 179.956 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.77 0.319 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -130.18 107.88 9.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.859 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.01 109.7 8.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.884 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.86 123.03 43.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.872 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.4 149.89 27.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.973 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt -72.96 118.16 15.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.898 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.99 157.09 35.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.902 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -89.12 142.06 27.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.765 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.4 mmmt -83.62 107.97 16.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.017 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -140.33 133.74 15.08 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.698 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.425 ' HA ' ' HA ' ' A' ' 73' ' ' GLU . 98.4 Cg_endo -79.55 112.58 2.98 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.435 2.09 . . . . 0.0 112.636 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.647 ' HB1' ' O ' ' A' ' 26' ' ' MET . . . -166.07 104.6 0.66 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.026 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.818 HG23 HD22 ' A' ' 25' ' ' LEU . 0.3 OUTLIER -174.14 9.0 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.253 -0.43 . . . . 0.0 112.063 179.816 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.7 tp -98.67 85.08 3.26 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 120.691 -0.403 . . . . 0.0 111.346 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.608 HD11 ' N ' ' A' ' 26' ' ' MET . 32.5 mt -126.8 -68.43 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.91 178.348 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.9 tptt -130.99 122.76 27.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.297 178.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.879 ' HB2' ' CZ3' ' A' ' 66' ' ' TRP . . . -76.91 120.86 22.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.086 0.47 . . . . 0.0 112.028 -178.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.67 HD13 ' O ' ' A' ' 17' ' ' ALA . 25.0 mm -147.51 158.59 8.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.221 179.344 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.481 ' N ' HG22 ' A' ' 18' ' ' ILE . 0.8 OUTLIER -67.82 -176.16 0.63 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.534 179.836 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -66.84 70.22 0.18 Allowed Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.079 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.422 ' N ' ' O ' ' A' ' 19' ' ' ASP . 8.6 t70 -147.71 -51.98 0.19 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.912 0.386 . . . . 0.0 110.623 -179.687 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.455 ' HA ' ' O ' ' A' ' 34' ' ' PHE . 1.5 t -154.55 106.38 2.72 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.578 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.566 HG23 ' HB2' ' A' ' 34' ' ' PHE . 2.6 m -132.67 113.92 21.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.898 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.431 ' HG3' HG21 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -79.94 138.75 37.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.13 0.491 . . . . 0.0 112.011 -178.575 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.818 HD22 HG23 ' A' ' 13' ' ' THR . 0.1 OUTLIER -121.6 127.33 50.77 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.035 179.409 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.647 ' O ' ' HB1' ' A' ' 12' ' ' ALA . 0.4 OUTLIER -72.83 99.59 2.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.93 0.395 . . . . 0.0 110.886 -179.753 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -117.38 114.4 23.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.806 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 59.91 28.15 17.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.812 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 82.66 18.98 64.67 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.72 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.34 128.07 21.03 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.656 0.228 . . . . 0.0 110.952 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -74.14 126.93 10.87 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.444 2.096 . . . . 0.0 112.227 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 18.5 mmt -119.17 110.73 17.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.167 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.4 HG23 ' OG1' ' A' ' 22' ' ' THR . 14.3 m -70.98 157.13 38.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.334 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.814 ' CE1' HD11 ' A' ' 25' ' ' LEU . 1.9 m-85 -120.33 158.97 25.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.581 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -116.57 148.31 41.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.979 0.418 . . . . 0.0 111.082 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.762 HD23 ' O ' ' A' ' 37' ' ' LEU . 6.2 tt -48.71 119.46 3.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.487 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.762 ' O ' HD23 ' A' ' 36' ' ' LEU . 1.9 pp -49.06 165.23 0.06 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.912 179.515 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.464 ' O ' ' O ' ' A' ' 37' ' ' LEU . 23.0 tp -31.99 156.68 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.2 t -61.37 133.74 26.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.778 -179.423 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.4 ' O ' ' HD3' ' A' ' 42' ' ' PRO . 6.3 p30 -137.04 165.7 25.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.307 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.509 HG23 ' H ' ' A' ' 49' ' ' LYS . 92.3 m -76.26 112.06 18.86 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.962 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.433 ' CG ' ' HB3' ' A' ' 46' ' ' HIS . 97.5 Cg_endo -84.3 163.29 13.07 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.867 2.378 . . . . 0.0 112.524 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -130.51 -41.86 1.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.367 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.525 HG23 ' O ' ' A' ' 44' ' ' THR . 7.1 t -60.93 100.36 0.11 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.854 0.359 . . . . 0.0 111.218 -179.503 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 44.92 20.86 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.334 179.575 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.433 ' HB3' ' CG ' ' A' ' 42' ' ' PRO . 2.5 m80 -121.88 127.68 25.89 Favored Pre-proline 0 C--N 1.33 -0.249 0 O-C-N 122.47 -0.144 . . . . 0.0 111.051 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -57.47 151.08 55.89 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.292 1.995 . . . . 0.0 112.148 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.75 166.11 5.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.909 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.509 ' H ' HG23 ' A' ' 41' ' ' THR . 0.3 OUTLIER -117.49 -81.45 0.62 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.964 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -151.43 -46.79 0.02 OUTLIER Glycine 0 C--N 1.332 0.319 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.776 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 31.6 m -70.87 169.53 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.88 0.371 . . . . 0.0 111.246 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -108.12 168.36 9.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.865 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.2 mttp -60.08 91.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.857 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -131.63 20.16 4.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.182 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 172.58 59.84 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.679 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -78.22 -27.68 5.3 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.517 2.145 . . . . 0.0 112.397 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.445 ' HG3' ' HB3' ' A' ' 60' ' ' ALA . 1.5 tp10 -65.04 -15.89 62.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.333 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -49.46 -33.49 14.37 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.835 0.35 . . . . 0.0 111.38 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -88.87 -24.1 22.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.042 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.445 ' HB3' ' HG3' ' A' ' 57' ' ' GLU . . . -76.16 -28.85 57.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.253 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -56.88 -48.01 79.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.939 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.577 ' HB ' HD11 ' A' ' 92' ' ' ILE . 1.3 t -64.63 -15.48 61.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.383 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.5 tttp -89.14 -66.47 0.92 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.414 ' O ' ' N ' ' A' ' 68' ' ' ASN . 8.8 mttt -88.79 -64.34 1.16 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.978 0.418 . . . . 0.0 111.998 -178.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.416 ' O ' ' HB3' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -51.91 -21.53 3.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.745 -179.302 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' TRP . . . . . 0.879 ' CZ3' ' HB2' ' A' ' 17' ' ' ALA . 22.9 t90 -99.2 -37.34 9.33 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -179.527 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -94.11 -49.02 5.95 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -178.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.414 ' N ' ' O ' ' A' ' 64' ' ' LYS . 91.3 m-20 -79.72 -28.37 40.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.663 0.268 . . . . 0.0 111.565 -179.171 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 65' ' ' MET . . . -108.15 151.05 26.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.747 0.308 . . . . 0.0 111.092 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.2 mmtt -96.35 96.01 8.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.27 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.714 ' HB2' ' N ' ' A' ' 95' ' ' ASP . 0.0 OUTLIER -166.14 100.52 0.63 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.648 179.577 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.693 HD13 ' N ' ' A' ' 72' ' ' ILE . 0.0 OUTLIER -139.23 105.27 2.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.471 -179.659 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.425 ' HA ' ' HA ' ' A' ' 11' ' ' PRO . 2.6 mt-10 -128.73 169.7 14.19 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.249 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.527 HG22 HD13 ' A' ' 25' ' ' LEU . 21.1 t -115.18 147.4 18.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.852 179.722 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.42 ' HB2' ' CE2' ' A' ' 93' ' ' TYR . 4.8 tt0 -110.78 -69.95 0.84 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.696 0.284 . . . . 0.0 111.613 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -110.04 118.16 35.67 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.896 0.379 . . . . 0.0 111.371 -179.318 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -104.2 91.83 4.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.464 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -61.18 -83.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.043 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 91.86 -29.0 7.79 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.712 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -110.69 -38.35 5.18 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.785 0.326 . . . . 0.0 110.893 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.4 ttt-85 -75.99 63.39 1.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.81 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.414 ' CG2' ' HA2' ' A' ' 86' ' ' GLY . 10.4 p -87.7 151.09 23.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.712 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -114.97 -51.9 2.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.25 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.79 -64.03 1.32 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.866 0.365 . . . . 0.0 111.286 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -133.79 12.39 4.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.447 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.414 ' HA2' ' CG2' ' A' ' 82' ' ' THR . . . 128.08 0.75 6.41 Favored Glycine 0 CA--C 1.519 0.342 0 C-N-CA 120.518 -0.849 . . . . 0.0 112.963 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -107.77 98.98 8.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.953 0.406 . . . . 0.0 110.978 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -117.32 -85.47 1.11 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.274 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.2 tp -102.28 101.01 11.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.721 0.296 . . . . 0.0 110.676 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.707 ' HB1' ' CD2' ' A' ' 34' ' ' PHE . . . -152.24 137.75 17.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.923 0.392 . . . . 0.0 111.506 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -142.15 122.23 13.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.635 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.577 HD11 ' HB ' ' A' ' 62' ' ' THR . 2.7 pt -89.49 149.9 3.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.832 0.349 . . . . 0.0 111.275 -179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.499 ' CD1' ' HA2' ' A' ' 96' ' ' GLY . 0.0 OUTLIER -137.77 168.09 20.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.081 179.466 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.615 ' HB1' ' HG3' ' A' ' 71' ' ' LYS . . . -94.08 99.73 11.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.715 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.714 ' N ' ' HB2' ' A' ' 71' ' ' LYS . 1.9 t0 76.6 21.0 1.34 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.125 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.499 ' HA2' ' CD1' ' A' ' 93' ' ' TYR . . . 45.27 53.87 7.6 Favored Glycine 0 CA--C 1.517 0.184 0 C-N-CA 121.035 -0.602 . . . . 0.0 112.912 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.88 99.79 12.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.878 0.37 . . . . 0.0 110.93 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.87 137.22 32.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.803 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.8 m -104.26 92.68 2.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.11 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 12.1 p-10 -168.87 -41.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.934 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 62.25 108.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.902 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -129.12 -73.54 0.57 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.02 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 5.1 mp 58.98 106.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.942 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.617 HG21 ' HB2' ' A' ' 109' ' ' ALA . 21.5 t -96.44 -66.68 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.114 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.02 -49.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.857 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.51 -46.02 0.98 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.842 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 140.22 44.31 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.532 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.7 mp -137.95 -52.61 0.63 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.86 0.362 . . . . 0.0 110.896 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.617 ' HB2' HG21 ' A' ' 104' ' ' VAL . . . 59.46 85.14 0.1 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.131 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.9 mmtt . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.895 -179.95 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.786 0.326 . . . . 0.0 111.042 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.4 m -111.88 95.78 5.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.913 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 30.3 t -101.85 114.92 29.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.87 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.2 p -105.35 117.82 34.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.822 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.28 113.09 25.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.918 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.2 mtpt -116.53 140.59 49.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.897 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.573 HD13 ' H ' ' A' ' 8' ' ' HIS . 0.2 OUTLIER -101.96 151.19 22.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.942 -179.96 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.573 ' H ' HD13 ' A' ' 7' ' ' LEU . 13.7 t60 -120.56 88.92 3.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.675 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.72 158.18 29.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.01 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -104.76 158.6 31.67 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.714 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -78.87 157.31 27.42 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.426 2.084 . . . . 0.0 112.535 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.706 ' HB1' ' O ' ' A' ' 26' ' ' MET . . . -120.29 -90.25 0.58 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.318 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.662 HG23 ' O ' ' A' ' 12' ' ' ALA . 0.1 OUTLIER 175.67 164.24 0.33 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.89 0.376 . . . . 0.0 110.875 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.452 ' CB ' ' CZ2' ' A' ' 66' ' ' TRP . 1.7 pp -90.12 139.88 30.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.827 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.541 HD11 ' N ' ' A' ' 26' ' ' MET . 3.4 mt -125.08 -77.1 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.392 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.741 ' O ' HG13 ' A' ' 23' ' ' VAL . 18.9 mtpt -145.2 137.99 26.21 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.88 0.372 . . . . 0.0 110.961 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -126.35 106.3 9.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.984 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.691 HG23 ' H ' ' A' ' 19' ' ' ASP . 0.7 OUTLIER -51.28 -77.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.311 -179.858 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.691 ' H ' HG23 ' A' ' 18' ' ' ILE . 0.5 OUTLIER -118.16 -80.97 0.62 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.739 0.304 . . . . 0.0 110.841 179.896 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -174.71 33.5 0.1 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.528 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -122.08 -35.53 3.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.69 0.281 . . . . 0.0 111.039 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 t -147.03 139.58 24.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.808 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.741 HG13 ' O ' ' A' ' 16' ' ' LYS . 29.4 t -142.79 129.58 18.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.277 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.438 ' HA ' ' O ' ' A' ' 32' ' ' MET . 0.0 OUTLIER -79.65 143.68 34.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.203 -179.76 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.676 HD11 ' OH ' ' A' ' 91' ' ' TYR . 0.4 OUTLIER -136.52 165.01 26.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.645 179.797 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.706 ' O ' ' HB1' ' A' ' 12' ' ' ALA . 23.3 mmt -84.98 99.85 11.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.858 0.361 . . . . 0.0 110.87 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -115.63 95.7 5.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.868 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.6 mmtm 58.32 30.18 19.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.956 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 91.33 -14.07 64.73 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.629 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -99.31 141.42 22.81 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 120.694 0.283 . . . . 0.0 110.871 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.54 134.71 15.59 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.514 2.142 . . . . 0.0 112.249 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.455 ' HB3' ' CE1' ' A' ' 34' ' ' PHE . 3.5 mmt -129.19 110.54 12.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.926 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.72 86.75 4.15 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.918 -179.639 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.505 ' HB2' ' CD1' ' A' ' 91' ' ' TYR . 0.5 OUTLIER -137.78 107.11 6.1 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.779 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 tpt180 -140.38 127.72 21.22 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.481 HD22 ' O ' ' A' ' 89' ' ' LEU . 6.9 tp -143.12 111.06 5.99 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.349 178.354 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.676 HD11 ' HB1' ' A' ' 58' ' ' ALA . 0.6 OUTLIER -143.99 149.69 37.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.076 0.465 . . . . 0.0 111.603 -179.59 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -151.13 96.91 2.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.36 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.944 HG21 ' CD2' ' A' ' 61' ' ' PHE . 26.9 m -97.24 121.42 47.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.547 -179.424 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -137.14 96.19 3.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.796 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.518 HG22 ' HB2' ' A' ' 47' ' ' PRO . 0.5 OUTLIER -156.83 120.06 2.24 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.179 -179.88 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -57.52 163.24 8.94 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.467 2.111 . . . . 0.0 112.305 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -106.78 3.82 26.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.469 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.434 HG23 ' O ' ' A' ' 44' ' ' THR . 10.0 t -111.06 119.01 37.6 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.697 0.284 . . . . 0.0 110.916 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.17 -148.38 0.45 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.221 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.25 116.88 49.16 Favored Pre-proline 0 C--O 1.232 0.149 0 O-C-N 122.31 -0.243 . . . . 0.0 110.651 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.518 ' HB2' HG22 ' A' ' 41' ' ' THR . 37.3 Cg_endo -66.13 105.87 0.91 Allowed 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.428 2.085 . . . . 0.0 112.645 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.43 96.71 4.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.589 179.443 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 50.57 96.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.958 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -123.46 -105.28 1.72 Allowed Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.735 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 27.7 m -70.9 147.09 11.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.729 0.299 . . . . 0.0 111.203 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -100.41 179.03 4.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.828 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -81.36 90.98 6.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.93 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -87.81 -32.48 19.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.824 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 130.42 -81.66 0.33 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.469 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -52.43 -28.72 36.69 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.602 2.201 . . . . 0.0 112.325 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -67.44 -36.12 80.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.854 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.676 ' HB1' HD11 ' A' ' 37' ' ' LEU . . . -72.82 -32.77 65.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.102 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.7 t -60.08 -31.36 69.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.884 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -85.81 -29.98 23.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.199 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.944 ' CD2' HG21 ' A' ' 39' ' ' VAL . 1.5 t80 -60.25 -47.18 87.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.915 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.404 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 14.8 p -58.09 -50.08 74.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.82 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -21.63 9.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.107 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.3 tttm -88.44 -59.37 2.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.833 0.349 . . . . 0.0 110.961 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.8 mtt -90.27 -56.35 3.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.489 -179.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' TRP . . . . . 0.452 ' CZ2' ' CB ' ' A' ' 14' ' ' LEU . 28.4 t90 -53.94 -24.75 17.49 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.71 0.263 . . . . 0.0 111.71 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.32 -48.32 6.21 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.567 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.93 -28.2 39.75 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.08 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.53 ' HB3' ' HD3' ' A' ' 71' ' ' LYS . . . -105.02 151.23 24.21 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.785 0.326 . . . . 0.0 110.814 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.1 mmtt -95.37 92.95 6.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.878 -179.198 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.593 ' HB2' ' O ' ' A' ' 93' ' ' TYR . 0.0 OUTLIER -142.77 96.97 3.02 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.845 178.692 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.666 ' O ' HG23 ' A' ' 72' ' ' ILE . 0.5 OUTLIER -141.58 103.07 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.076 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.571 ' CB ' ' HB2' ' A' ' 93' ' ' TYR . 0.0 OUTLIER -166.81 178.65 5.75 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.664 -0.414 . . . . 0.0 111.263 177.862 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 90' ' ' ALA . 11.7 p -123.45 153.02 28.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.889 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -99.52 -118.38 0.15 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.588 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 54.8 p90 -107.07 134.15 50.63 Favored 'General case' 0 N--CA 1.457 -0.085 0 CA-C-O 120.798 0.332 . . . . 0.0 111.039 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.7 p-10 -78.7 117.95 20.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.942 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.25 -34.0 19.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.996 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 57.64 28.78 60.37 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.492 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -91.97 -64.05 1.16 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.718 0.294 . . . . 0.0 110.9 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -54.81 42.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.826 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.425 HG23 ' O ' ' A' ' 82' ' ' THR . 11.9 t -70.72 120.86 16.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.622 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -115.38 -51.27 2.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.971 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.7 pttm -101.41 -29.34 12.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.898 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.14 -35.65 76.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.54 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 67.7 24.19 74.04 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.684 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.427 ' HA ' ' CE2' ' A' ' 34' ' ' PHE . 0.6 OUTLIER -121.32 97.95 5.75 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.26 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -61.71 115.88 8.57 Favored Glycine 0 N--CA 1.452 -0.296 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 178.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.481 ' O ' HD22 ' A' ' 36' ' ' LEU . 1.5 mt -77.25 97.3 4.79 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.151 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.487 ' O ' HG23 ' A' ' 74' ' ' VAL . . . -174.17 114.24 0.19 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.116 177.722 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.676 ' OH ' HD11 ' A' ' 25' ' ' LEU . 0.3 OUTLIER -145.21 94.35 2.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.476 179.156 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 6.6 pt -150.17 108.86 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 C-N-CA 120.409 -0.516 . . . . 0.0 111.953 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.593 ' O ' ' HB2' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -151.65 168.78 23.91 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.387 179.294 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -122.07 106.48 11.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.833 0.349 . . . . 0.0 111.233 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.4 t0 52.07 26.21 3.66 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.835 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 77.8 13.88 82.97 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.57 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.5 mtpm? -136.96 149.22 47.42 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.735 0.302 . . . . 0.0 110.873 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 1.3 ttt -82.71 110.37 17.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.925 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.419 ' O ' HG12 ' A' ' 99' ' ' VAL . 31.4 t 59.5 62.28 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.102 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 57.11 -168.17 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.064 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -97.98 -46.47 5.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.05 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -106.2 139.21 41.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.077 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -123.82 -68.42 0.87 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.988 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.2 t 58.99 103.92 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.08 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 22.8 ptt180 -152.14 -43.86 0.11 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.928 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -168.35 35.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.976 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -115.84 -129.98 4.59 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.422 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.9 mp -76.69 -21.1 55.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.63 0.253 . . . . 0.0 110.953 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 66.49 98.14 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.889 0.376 . . . . 0.0 111.075 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.186 -0.911 . . . . 0.0 110.851 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.854 0.359 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 18.2 p -125.68 138.02 53.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.868 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -111.99 143.78 42.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.943 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.9 p -111.95 154.07 25.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.948 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -55.1 148.05 14.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.109 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -115.28 106.8 14.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.858 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.408 HD13 ' C ' ' A' ' 75' ' ' GLU . 1.7 pp -69.96 156.9 38.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.146 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 12.9 t60 -90.49 159.1 16.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.704 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.52 120.41 42.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.915 0.388 . . . . 0.0 111.356 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.826 ' O ' HG23 ' A' ' 74' ' ' VAL . 12.5 mt-10 -137.83 129.02 15.98 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.336 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.757 ' HA ' ' HA ' ' A' ' 73' ' ' GLU . 87.7 Cg_endo -82.76 158.84 16.24 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.42 2.08 . . . . 0.0 112.939 -179.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.933 ' HB2' HD12 ' A' ' 25' ' ' LEU . . . -115.84 -129.87 0.3 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.56 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.645 HG23 ' O ' ' A' ' 12' ' ' ALA . 0.1 OUTLIER 175.99 -86.74 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.218 0 O-C-N 122.269 -0.27 . . . . 0.0 111.698 179.784 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.37 112.39 23.97 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.852 0.358 . . . . 0.0 111.234 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.807 HD11 HG21 ' A' ' 72' ' ' ILE . 2.6 mp -125.47 160.21 31.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.241 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.637 ' O ' HG12 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -115.19 122.8 47.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.374 179.439 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.405 ' HA ' HG12 ' A' ' 23' ' ' VAL . . . -112.29 123.61 50.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.447 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.636 HG23 ' H ' ' A' ' 19' ' ' ASP . 0.5 OUTLIER -117.87 -89.43 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.812 179.755 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.636 ' H ' HG23 ' A' ' 18' ' ' ILE . 1.0 OUTLIER -118.32 28.84 8.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.716 0.294 . . . . 0.0 110.977 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.551 ' HA3' HD23 ' A' ' 36' ' ' LEU . . . 61.32 57.42 18.34 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.233 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -147.19 -44.26 0.17 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.805 0.336 . . . . 0.0 110.795 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 54.6 p -132.51 106.87 8.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.182 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.637 HG12 ' O ' ' A' ' 16' ' ' LYS . 27.5 m -128.76 113.71 30.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.52 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.537 ' HB3' HG23 ' A' ' 33' ' ' THR . 12.6 ptmt -90.35 105.54 17.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.681 -179.257 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.933 HD12 ' HB2' ' A' ' 12' ' ' ALA . 1.7 pt? -108.1 165.05 11.77 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.347 179.404 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 2.7 ttm -77.37 99.85 5.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.857 0.361 . . . . 0.0 111.047 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.407 ' CE2' HG21 ' A' ' 74' ' ' VAL . 36.6 t80 -115.0 100.33 8.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.744 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 61.16 31.04 19.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.896 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.39 24.28 66.04 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.549 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -142.1 120.89 7.74 Favored Pre-proline 0 C--N 1.33 -0.257 0 O-C-N 122.769 -0.254 . . . . 0.0 110.981 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -59.72 132.41 45.3 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.353 2.035 . . . . 0.0 112.002 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 11.7 mtp -134.49 118.06 16.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.978 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.537 HG23 ' HB3' ' A' ' 24' ' ' LYS . 0.8 OUTLIER -95.59 127.21 41.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.102 -179.906 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.59 ' HE1' HD22 ' A' ' 25' ' ' LEU . 35.2 p90 -141.03 158.18 44.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.985 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -92.74 148.14 22.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.774 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.551 HD23 ' HA3' ' A' ' 20' ' ' GLY . 4.7 pp -48.98 153.95 0.81 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.297 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.765 ' HB3' ' HB3' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -66.96 155.05 39.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.093 -179.878 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.447 HD23 ' H ' ' A' ' 38' ' ' LEU . 0.7 OUTLIER -113.02 131.58 55.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.818 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.8 m -84.86 137.83 20.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.195 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -95.12 123.41 38.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.905 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.454 HG23 ' HD2' ' A' ' 42' ' ' PRO . 71.5 m -88.35 139.44 30.16 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.826 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.454 ' HD2' HG23 ' A' ' 41' ' ' THR . 39.8 Cg_endo -67.19 148.75 81.2 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.471 2.114 . . . . 0.0 112.169 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -69.64 -28.59 66.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.027 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.7 m -75.06 147.68 40.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.105 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 4.0 mtpm? 63.14 -80.17 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.208 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.441 ' CG ' ' HD2' ' A' ' 47' ' ' PRO . 1.8 t-80 -91.39 148.4 37.51 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.944 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.441 ' HD2' ' CG ' ' A' ' 46' ' ' HIS . 48.5 Cg_exo -55.71 153.44 30.12 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.528 2.152 . . . . 0.0 112.236 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.4 tttp -92.74 107.78 19.48 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.805 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.72 130.37 4.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.853 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.99 86.19 0.38 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.447 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 27.5 m -71.05 161.56 4.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.726 0.298 . . . . 0.0 111.138 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.507 ' OE2' HD11 ' A' ' 36' ' ' LEU . 0.1 OUTLIER -108.01 151.69 25.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.848 -179.997 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 6.5 mtpm? -59.68 95.88 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.898 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.4 p90 -96.75 27.6 3.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.03 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -113.98 166.68 12.17 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.589 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.43 -18.9 29.3 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.656 2.237 . . . . 0.0 112.569 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -52.53 -25.71 11.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.32 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.03 -60.77 3.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.412 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 94.8 p -92.93 -16.04 25.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.538 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -83.84 -61.76 1.74 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.716 0.293 . . . . 0.0 111.451 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -54.78 -53.87 49.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.259 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.522 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 36.9 p -59.7 -21.05 60.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.233 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.403 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 11.5 tttt -89.11 -19.48 25.49 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.334 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp -88.59 -64.18 1.18 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.857 -179.27 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -89.14 -54.31 4.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.685 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' TRP . . . . . 0.522 ' HB3' ' O ' ' A' ' 62' ' ' THR . 37.8 t90 -58.75 -18.55 32.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.713 -179.281 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.403 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -90.81 -44.6 9.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.826 0.346 . . . . 0.0 111.192 -179.935 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -79.99 -28.04 39.56 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.184 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -108.04 151.21 26.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.86 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.2 ptpt -100.83 92.6 5.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.407 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.416 ' HG3' ' HA ' ' A' ' 94' ' ' ALA . 0.0 OUTLIER -138.26 98.03 3.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.052 179.423 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.807 HG21 HD11 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -139.86 119.88 13.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.771 0.319 . . . . 0.0 111.596 -179.545 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.757 ' HA ' ' HA ' ' A' ' 11' ' ' PRO . 10.4 mt-10 -149.25 172.11 15.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.479 179.642 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.826 HG23 ' O ' ' A' ' 10' ' ' GLU . 34.9 t -100.85 141.57 17.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.4 -179.296 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.408 ' C ' HD13 ' A' ' 7' ' ' LEU . 0.9 OUTLIER -135.14 -2.86 2.5 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -179.744 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.467 ' CD1' ' HB3' ' A' ' 91' ' ' TYR . 0.0 OUTLIER -92.68 164.32 13.43 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.884 0.373 . . . . 0.0 111.573 -179.634 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.406 ' CB ' ' HB3' ' A' ' 7' ' ' LEU . 3.1 t70 -100.85 139.19 36.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.911 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.0 pttp -68.77 108.44 3.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.954 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 88.08 41.11 6.35 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.481 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.12 -63.69 1.36 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.785 0.326 . . . . 0.0 110.816 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -162.12 94.82 0.93 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.007 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.449 ' HB ' ' HA2' ' A' ' 86' ' ' GLY . 7.6 p -74.37 154.31 38.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.769 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -115.23 -51.8 2.7 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.293 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.6 tptt -110.74 -64.0 1.33 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.788 0.328 . . . . 0.0 111.612 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.415 ' O ' ' CG ' ' A' ' 85' ' ' TYR . 81.9 t80 -133.9 11.15 3.96 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.623 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.449 ' HA2' ' HB ' ' A' ' 82' ' ' THR . . . 128.09 -15.33 6.18 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.573 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -90.3 98.76 11.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.781 0.324 . . . . 0.0 110.929 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -147.11 -44.54 0.03 OUTLIER Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.438 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.41 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 4.3 mm? -81.5 148.36 29.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.897 0.38 . . . . 0.0 110.904 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.765 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . . . -102.67 142.56 33.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.206 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.718 ' HB2' HG13 ' A' ' 74' ' ' VAL . 1.8 p90 -141.04 88.01 2.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.012 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -150.2 141.2 16.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.081 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.442 ' CD1' ' HG3' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -123.36 117.99 26.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.619 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.416 ' HA ' ' HG3' ' A' ' 71' ' ' LYS . . . -111.43 91.87 3.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.051 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 58.2 23.81 10.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.065 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -74.56 -100.96 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.551 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? -107.7 109.83 21.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.903 0.382 . . . . 0.0 110.887 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 7.9 mtp -78.43 131.09 36.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.885 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 9.7 m -74.67 128.07 36.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.113 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -71.8 82.6 0.89 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.908 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -135.82 142.86 44.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.83 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -82.05 -67.74 0.76 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.119 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.527 HD13 ' OXT' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -149.79 -78.29 0.14 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.899 179.896 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.4 t 57.2 90.07 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.214 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -137.44 -58.53 0.69 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.877 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -116.22 -41.44 3.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.857 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -173.47 -97.46 0.11 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.435 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -130.94 31.92 4.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.773 0.32 . . . . 0.0 110.854 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -125.4 148.74 48.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.082 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.527 ' OXT' HD13 ' A' ' 103' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.285 -0.865 . . . . 0.0 110.8 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.698 0.285 . . . . 0.0 111.023 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.02 107.98 18.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.908 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 63.8 p -107.22 110.19 22.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.959 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 40.9 p -76.75 123.86 26.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.824 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.19 108.63 19.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.918 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 tppm? -104.13 100.97 10.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.81 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.833 HD13 ' N ' ' A' ' 8' ' ' HIS . 0.7 OUTLIER -96.2 146.62 24.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.92 -179.883 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.833 ' N ' HD13 ' A' ' 7' ' ' LEU . 2.1 m-70 -114.03 109.77 18.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.912 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.787 ' CB ' HG23 ' A' ' 74' ' ' VAL . 1.0 OUTLIER -122.04 159.09 27.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.154 -179.852 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -104.09 164.27 15.66 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.627 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.447 ' CA ' ' HG3' ' A' ' 73' ' ' GLU . 91.0 Cg_endo -78.48 150.07 24.7 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.596 2.197 . . . . 0.0 112.692 -179.392 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.726 ' HB1' ' O ' ' A' ' 26' ' ' MET . . . -121.34 -81.86 0.64 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.194 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.67 HG23 ' O ' ' A' ' 12' ' ' ALA . 0.1 OUTLIER 171.36 131.25 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.725 0.298 . . . . 0.0 111.001 -179.984 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.742 HD13 ' N ' ' A' ' 15' ' ' ILE . 0.3 OUTLIER -98.19 130.29 44.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.994 179.716 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.742 ' N ' HD13 ' A' ' 14' ' ' LEU . 0.8 OUTLIER -84.46 -51.52 13.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.231 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.421 ' H ' HG13 ' A' ' 15' ' ' ILE . 14.2 tttm -164.46 151.26 11.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.518 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.687 ' HA ' HG12 ' A' ' 23' ' ' VAL . . . -125.43 148.05 48.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.406 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.9 pt -123.82 -167.0 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.914 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -71.19 62.7 0.33 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.796 0.332 . . . . 0.0 111.431 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.427 ' HA3' ' CD2' ' A' ' 36' ' ' LEU . . . 44.33 77.22 0.1 OUTLIER Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.989 -0.625 . . . . 0.0 113.095 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -147.64 -46.26 0.17 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.98 0.419 . . . . 0.0 110.796 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -167.99 106.93 0.52 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.873 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.776 HG22 ' O ' ' A' ' 34' ' ' PHE . 32.6 m -121.35 113.85 41.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.672 179.582 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.4 ' O ' HG13 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -87.66 147.4 25.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.358 -179.548 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.768 HD21 ' CD2' ' A' ' 34' ' ' PHE . 0.1 OUTLIER -137.99 137.21 37.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.176 179.622 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.726 ' O ' ' HB1' ' A' ' 12' ' ' ALA . 3.1 tpt -72.75 99.43 2.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.923 0.392 . . . . 0.0 110.863 -179.52 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -118.78 116.22 26.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.702 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 25.4 mmtm 58.86 28.09 17.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.89 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.12 25.5 66.28 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.553 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -142.07 113.07 6.28 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 120.453 0.168 . . . . 0.0 110.901 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.83 141.0 95.9 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.477 2.118 . . . . 0.0 112.271 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.439 ' HB3' ' CZ ' ' A' ' 34' ' ' PHE . 0.6 OUTLIER -142.2 110.92 6.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.979 -179.848 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.422 ' O ' ' CD1' ' A' ' 34' ' ' PHE . 1.4 t -78.28 139.9 38.86 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.196 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.776 ' O ' HG22 ' A' ' 23' ' ' VAL . 26.0 m-85 -141.39 138.51 33.04 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.194 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -101.11 148.07 25.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.641 179.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.447 ' O ' HD12 ' A' ' 36' ' ' LEU . 0.3 OUTLIER -56.57 169.3 0.48 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.34 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.685 ' H ' HD13 ' A' ' 37' ' ' LEU . 0.0 OUTLIER -95.73 163.06 13.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.932 179.832 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.41 96.88 7.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.772 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.488 ' O ' HG13 ' A' ' 39' ' ' VAL . 14.3 p -108.6 121.45 61.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.168 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -122.71 145.14 48.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.846 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.8 t -102.04 116.23 63.5 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.924 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -67.59 161.28 44.24 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.436 2.091 . . . . 0.0 112.173 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.58 -82.54 0.05 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.82 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -111.14 100.95 9.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.94 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -177.9 -78.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.92 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -112.73 163.84 16.9 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.946 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -53.04 148.81 29.11 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.556 2.171 . . . . 0.0 112.299 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -78.64 142.41 37.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.963 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 2.7 pttp -168.25 -43.5 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.943 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -60.85 169.84 8.5 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.539 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.501 HG22 ' N ' ' A' ' 52' ' ' GLU . 11.3 p -102.95 159.31 4.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.79 0.329 . . . . 0.0 111.059 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.501 ' N ' HG22 ' A' ' 51' ' ' VAL . 1.6 mp0 -92.85 149.97 20.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.808 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.91 90.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.894 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -112.59 -33.91 5.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.915 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 136.27 -147.97 19.46 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.445 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -69.2 -9.97 27.74 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.584 2.189 . . . . 0.0 112.6 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.81 -29.69 55.25 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.746 0.308 . . . . 0.0 110.997 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.24 -31.01 68.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.046 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 t -71.59 -24.12 61.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.063 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -55.5 -23.24 24.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.371 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -53.38 -52.06 60.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.085 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.405 ' O ' ' N ' ' A' ' 66' ' ' TRP . 1.3 p -60.98 -47.86 84.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.966 0.412 . . . . 0.0 110.914 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.2 mtmt -55.7 -20.03 12.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.358 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.4 tptt -84.98 -59.8 2.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.722 0.296 . . . . 0.0 111.37 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 14.0 mtt -90.01 -49.9 6.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.313 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' TRP . . . . . 0.862 ' CE2' HG22 ' A' ' 72' ' ' ILE . 10.0 t-105 -54.79 -34.72 63.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.303 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -94.49 -52.13 4.46 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -79.79 -28.38 40.3 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.353 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.637 ' HB3' ' HD3' ' A' ' 71' ' ' LYS . . . -107.22 151.16 25.8 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.839 0.352 . . . . 0.0 111.224 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.4 tttt -89.69 92.99 9.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.568 -179.204 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.637 ' HD3' ' HB3' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -166.22 98.33 0.61 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.556 179.096 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.862 HG22 ' CE2' ' A' ' 66' ' ' TRP . 4.8 pt -139.9 128.79 27.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.0 0.428 . . . . 0.0 111.828 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.447 ' HG3' ' CA ' ' A' ' 11' ' ' PRO . 0.2 OUTLIER -162.42 171.02 17.81 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.032 179.605 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.787 HG23 ' CB ' ' A' ' 9' ' ' LYS . 0.4 OUTLIER -111.28 152.99 13.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.809 179.699 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -93.51 -79.66 0.4 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.521 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.42 ' O ' ' CE1' ' A' ' 91' ' ' TYR . 7.0 p90 -129.73 141.44 50.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.807 0.337 . . . . 0.0 111.324 -179.57 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -104.05 110.38 22.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.748 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.421 ' HB2' HD21 ' A' ' 89' ' ' LEU . 1.6 tttt -58.83 -35.23 72.57 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.903 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 106.16 28.04 5.38 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.431 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -106.97 161.7 14.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.79 0.329 . . . . 0.0 110.839 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.77 45.15 2.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.883 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 1.8 p -95.88 126.49 41.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.945 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -115.12 -50.85 2.74 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.948 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -104.64 -21.67 13.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.139 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -55.45 -30.64 60.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.235 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 125.19 51.35 0.18 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.535 -0.841 . . . . 0.0 112.554 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.584 ' NE ' HD12 ' A' ' 89' ' ' LEU . 1.7 ttt85 -58.75 112.85 1.78 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.883 0.373 . . . . 0.0 110.959 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -105.32 22.07 33.72 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.779 -0.725 . . . . 0.0 112.561 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.584 HD12 ' NE ' ' A' ' 87' ' ' ARG . 38.2 mt -78.06 148.02 34.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.715 0.293 . . . . 0.0 110.695 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -105.95 134.29 49.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.033 0.444 . . . . 0.0 111.502 -179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.756 ' HB3' HG12 ' A' ' 74' ' ' VAL . 96.9 m-85 -142.12 90.22 2.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.456 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.623 HD13 ' O ' ' A' ' 91' ' ' TYR . 25.3 mm -133.82 116.89 24.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.983 0.421 . . . . 0.0 111.818 -179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.44 ' HB3' ' HB3' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -151.13 117.78 5.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.326 179.219 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.512 ' HB1' ' HG3' ' A' ' 71' ' ' LYS . . . -94.38 113.36 25.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.679 -179.349 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.512 ' N ' ' HB2' ' A' ' 71' ' ' LYS . 16.3 t70 49.97 25.91 1.82 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.985 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.14 102.69 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.237 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.3 mtpt -87.03 99.74 12.12 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.987 0.422 . . . . 0.0 110.781 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -82.16 141.74 32.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.786 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 12.0 p -104.19 -30.82 2.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.045 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -127.51 -72.16 0.64 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.998 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -176.8 -177.46 0.79 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.936 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -109.83 157.7 18.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.181 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 5.5 mt -93.57 -175.06 3.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.869 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 30.9 m -56.25 155.59 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.22 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.25 -62.19 1.56 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.929 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -158.4 32.48 0.24 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.029 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 139.36 -100.13 0.28 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.6 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.736 HD13 ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -118.5 73.81 0.93 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.843 0.354 . . . . 0.0 110.98 -179.877 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -57.82 -42.1 83.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.141 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 5.7 mtmt . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.131 -0.938 . . . . 0.0 111.002 179.883 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.778 0.323 . . . . 0.0 111.041 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 55.5 p -102.65 99.27 9.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.863 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.9 p -87.39 134.68 33.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.924 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.11 109.41 1.83 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.917 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -79.96 113.22 17.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.908 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.19 143.8 32.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.811 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.97 141.17 34.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.865 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -93.63 159.07 15.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.846 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.4 mttp -75.86 107.9 8.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.021 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.771 ' O ' HG12 ' A' ' 74' ' ' VAL . 2.4 mt-10 -139.13 143.54 37.11 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.521 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.522 ' HA ' ' HA ' ' A' ' 73' ' ' GLU . 84.2 Cg_endo -83.75 164.37 13.98 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.476 2.117 . . . . 0.0 112.711 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.816 ' HB1' HD22 ' A' ' 25' ' ' LEU . . . -119.29 104.69 10.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.999 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 44.7 p -64.69 80.94 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.273 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.745 HD22 ' HB ' ' A' ' 62' ' ' THR . 3.2 tt -69.7 120.96 16.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.431 179.559 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 26.4 mt -125.27 -69.86 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.863 ' O ' HG13 ' A' ' 23' ' ' VAL . 3.7 pttt -121.68 145.95 47.5 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.925 0.393 . . . . 0.0 111.435 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.761 ' HB2' HG22 ' A' ' 23' ' ' VAL . . . -124.08 147.52 47.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.868 179.648 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.6 mm -96.81 -88.92 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.346 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -118.25 107.32 13.77 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.8 0.333 . . . . 0.0 111.045 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 98.67 -113.99 4.89 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.447 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -123.25 16.39 9.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.599 0.237 . . . . 0.0 111.159 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.6 t -74.85 106.78 6.55 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.893 0.378 . . . . 0.0 110.725 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.863 HG13 ' O ' ' A' ' 16' ' ' LYS . 16.8 t -128.77 134.67 63.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.966 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.523 ' CD ' HG23 ' A' ' 33' ' ' THR . 0.0 OUTLIER -79.73 97.86 6.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.707 -179.928 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.816 HD22 ' HB1' ' A' ' 12' ' ' ALA . 0.2 OUTLIER -99.38 142.53 30.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.867 -179.769 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.76 100.0 3.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.915 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -96.73 100.42 11.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.873 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.9 tttm 56.31 31.35 18.43 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.988 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 90.54 20.92 39.12 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.823 -0.704 . . . . 0.0 112.576 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.89 112.5 6.88 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.572 0.225 . . . . 0.0 110.778 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.2 129.49 21.8 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.351 2.034 . . . . 0.0 112.358 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 34' ' ' PHE . 33.6 mmm -145.04 118.7 9.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.933 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.523 HG23 ' CD ' ' A' ' 24' ' ' LYS . 0.8 OUTLIER -70.38 135.34 48.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.077 -179.966 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.726 ' HB3' ' HB3' ' A' ' 90' ' ' ALA . 27.0 m-85 -140.69 152.75 45.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.907 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtt-85 -117.3 148.0 42.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.972 0.415 . . . . 0.0 111.081 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.653 HD12 ' HB3' ' A' ' 91' ' ' TYR . 35.0 tp -78.06 138.39 38.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.786 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.71 HD23 ' O ' ' A' ' 37' ' ' LEU . 8.5 tt -82.83 94.34 7.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.804 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.421 HD23 ' HG ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -124.88 163.33 22.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.909 -179.978 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.49 HG21 ' HB3' ' A' ' 49' ' ' LYS . 21.3 m -61.95 159.92 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.241 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -128.28 132.08 48.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.614 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.7 t -76.93 111.34 15.7 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.064 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -67.93 163.04 37.17 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.541 2.16 . . . . 0.0 112.191 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -98.27 37.87 1.4 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.802 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 69.0 p -103.71 103.84 13.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.041 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.2 mtpm? 62.04 -82.8 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.081 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -120.94 146.64 44.38 Favored Pre-proline 0 C--N 1.332 -0.185 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.07 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -74.43 125.89 9.95 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.619 2.212 . . . . 0.0 112.219 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.8 tttp -124.91 112.97 17.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.996 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.49 ' HB3' HG21 ' A' ' 39' ' ' VAL . 0.1 OUTLIER 61.57 118.05 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.924 179.891 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 158.65 127.4 0.92 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.505 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 28.8 t -110.23 106.11 20.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.847 0.356 . . . . 0.0 110.973 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -92.94 179.3 5.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.974 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.53 90.97 0.05 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.793 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -89.66 -32.89 16.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.955 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 155.42 -152.34 23.84 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.667 -0.777 . . . . 0.0 112.603 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -59.9 -16.41 38.22 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.745 2.297 . . . . 0.0 112.699 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -46.55 -29.19 1.68 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.429 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -77.46 -53.47 7.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.18 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.88 ' O ' HG22 ' A' ' 62' ' ' THR . 20.7 p -69.52 -24.54 63.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.238 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -54.72 -23.51 18.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.613 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -55.1 -31.11 60.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.815 0.34 . . . . 0.0 111.198 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.88 HG22 ' O ' ' A' ' 59' ' ' SER . 13.0 t -79.07 -17.48 55.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.279 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 67' ' ' GLU . 0.5 OUTLIER -89.41 -57.28 2.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.847 0.356 . . . . 0.0 111.441 -179.73 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.0 mtmp? -88.65 -59.18 2.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.205 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.847 ' HA ' ' HB3' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -55.67 -20.36 13.86 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.664 -179.347 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 66' ' ' TRP . . . . . 0.447 ' CE2' ' CG ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -99.22 -33.71 10.65 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.359 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.413 ' HB2' ' O ' ' A' ' 63' ' ' LYS . 5.2 mt-10 -94.0 -56.32 2.91 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 -179.534 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -80.17 -28.87 38.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.892 0.377 . . . . 0.0 110.991 -179.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.847 ' HB3' ' HA ' ' A' ' 65' ' ' MET . . . -108.78 152.6 24.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.698 179.489 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.401 ' HG2' ' HB3' ' A' ' 95' ' ' ASP . 0.0 OUTLIER -52.48 163.74 0.4 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.46 -179.754 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.447 ' CG ' ' CE2' ' A' ' 66' ' ' TRP . 0.1 OUTLIER -84.9 162.06 19.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.108 0.48 . . . . 0.0 111.486 -178.622 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.959 HD13 HG22 ' A' ' 92' ' ' ILE . 1.1 pp -102.83 145.22 12.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.849 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.522 ' HA ' ' HA ' ' A' ' 11' ' ' PRO . 44.5 mt-10 -127.89 179.1 5.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.634 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.771 HG12 ' O ' ' A' ' 10' ' ' GLU . 10.6 p -112.34 140.97 29.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.907 0.384 . . . . 0.0 111.055 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -106.88 -66.89 0.98 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.02 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 35.8 p90 -143.0 129.35 19.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.947 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.53 157.84 15.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.993 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -49.56 77.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.811 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 64.0 32.28 83.65 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.591 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -101.57 9.39 41.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.614 0.245 . . . . 0.0 111.315 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 26.4 mtm180 54.57 95.43 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.714 0.292 . . . . 0.0 111.175 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 41.7 m -62.2 148.98 42.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.908 0.385 . . . . 0.0 110.664 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -115.29 -40.18 3.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.287 -179.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.41 -63.11 1.02 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.245 -179.653 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -127.36 -35.15 2.21 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.15 -179.834 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 109.56 49.8 0.73 Allowed Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.728 -0.749 . . . . 0.0 111.845 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.403 ' HB2' ' CZ ' ' A' ' 87' ' ' ARG . 2.5 mtm105 -131.92 101.77 5.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.782 0.325 . . . . 0.0 111.022 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -48.83 171.44 0.07 OUTLIER Glycine 0 CA--C 1.518 0.26 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.415 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.4 mp -111.19 112.66 24.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.84 0.352 . . . . 0.0 111.192 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.726 ' HB3' ' HB3' ' A' ' 34' ' ' PHE . . . -128.62 130.08 46.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.798 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.653 ' HB3' HD12 ' A' ' 36' ' ' LEU . 0.0 OUTLIER -98.85 149.82 22.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.066 -179.762 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.959 HG22 HD13 ' A' ' 72' ' ' ILE . 2.7 pp -79.88 160.12 4.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.056 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.589 ' O ' HG22 ' A' ' 72' ' ' ILE . 5.8 m-85 -140.85 168.23 20.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.947 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.84 112.52 24.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.996 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.401 ' HB3' ' HG2' ' A' ' 70' ' ' LYS . 3.9 p30 45.21 41.93 6.46 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.412 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 104.69 -60.01 0.43 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.657 -0.783 . . . . 0.0 112.673 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.08 142.67 51.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.862 0.363 . . . . 0.0 110.966 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -60.09 140.37 56.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.026 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.48 HG12 ' N ' ' A' ' 100' ' ' ASN . 5.4 t -80.34 163.1 3.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.959 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.48 ' N ' HG12 ' A' ' 99' ' ' VAL . 29.1 p30 -47.27 164.18 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.181 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -57.73 136.91 56.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.998 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.417 ' HB2' HD13 ' A' ' 108' ' ' LEU . . . 62.05 115.89 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.264 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.522 HD22 HG13 ' A' ' 104' ' ' VAL . 1.4 tt -132.45 -66.78 0.68 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.899 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.522 HG13 HD22 ' A' ' 103' ' ' LEU . 13.0 m -144.66 30.9 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.028 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.06 -172.81 3.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.852 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 6.8 pm0 -109.89 29.05 7.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.074 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 136.45 63.09 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.739 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.516 ' N ' HD22 ' A' ' 108' ' ' LEU . 3.3 mm? 54.62 86.9 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.876 0.369 . . . . 0.0 111.173 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 63.29 -80.81 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.178 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.132 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.829 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.422 0 CA-C-O 120.717 0.294 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.4 t -107.19 95.31 5.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.805 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.8 m -74.45 128.84 36.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.958 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 76.9 p -68.18 104.01 1.7 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.904 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.72 157.03 21.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.897 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -69.01 137.48 53.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.956 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.601 HD11 ' HE2' ' A' ' 27' ' ' TYR . 0.5 OUTLIER -76.4 120.26 21.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.005 179.98 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.414 ' CE1' ' OH ' ' A' ' 27' ' ' TYR . 12.8 p-80 -70.99 157.19 38.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.703 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.6 mmtp -94.98 112.65 24.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.423 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.0 113.75 32.67 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.246 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.43 ' HA ' ' O ' ' A' ' 72' ' ' ILE . 83.1 Cg_endo -86.65 109.31 0.85 Allowed 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.513 2.142 . . . . 0.0 113.223 -178.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -166.42 -78.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.556 179.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.636 HG22 ' HB2' ' A' ' 25' ' ' LEU . 30.1 p 41.88 28.74 0.1 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 179.176 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.459 ' O ' HD13 ' A' ' 15' ' ' ILE . 1.0 OUTLIER -98.16 85.55 3.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.857 0.36 . . . . 0.0 110.563 179.411 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.475 HG21 ' HG2' ' A' ' 24' ' ' LYS . 10.5 mm -126.29 -69.81 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.88 179.556 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -141.85 173.04 11.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.304 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -122.35 140.0 53.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.034 0.445 . . . . 0.0 111.554 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.857 HG22 HG12 ' A' ' 23' ' ' VAL . 7.8 tt -173.6 164.23 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.768 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.42 171.97 5.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.784 0.326 . . . . 0.0 110.872 -179.656 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -60.86 82.98 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.617 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -147.27 -49.66 0.18 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.083 0.468 . . . . 0.0 110.47 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 t -172.06 106.58 0.2 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.515 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.857 HG12 HG22 ' A' ' 18' ' ' ILE . 35.9 m -122.52 127.59 75.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.122 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.475 ' HG2' HG21 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -79.21 133.99 36.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.864 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.649 HD23 ' O ' ' A' ' 32' ' ' MET . 0.5 OUTLIER -126.29 148.08 49.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.632 179.975 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.74 101.81 3.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.054 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.601 ' HE2' HD11 ' A' ' 7' ' ' LEU . 3.0 t80 -119.81 120.53 36.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.745 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.3 pttt 49.09 28.11 1.98 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.341 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.65 10.36 85.91 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.82 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.429 ' HA ' ' HD3' ' A' ' 31' ' ' PRO . 0.1 OUTLIER -121.97 142.46 36.44 Favored Pre-proline 0 CA--C 1.53 0.197 0 CA-C-N 116.726 0.263 . . . . 0.0 110.888 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 30' ' ' GLN . 35.0 Cg_exo -59.87 127.56 23.83 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.493 2.129 . . . . 0.0 112.264 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.649 ' O ' HD23 ' A' ' 25' ' ' LEU . 25.6 mmt -145.21 110.75 5.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.782 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' A' ' 23' ' ' VAL . 1.6 t -101.41 86.93 3.08 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.878 0.37 . . . . 0.0 111.829 -179.545 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.65 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -113.48 107.65 16.11 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.961 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.818 ' HA ' ' O ' ' A' ' 90' ' ' ALA . 16.5 tpt180 -143.88 95.01 2.66 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.202 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.927 HD22 HD23 ' A' ' 89' ' ' LEU . 0.1 OUTLIER -145.39 88.42 1.86 Allowed 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.386 178.551 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.66 HD12 HG13 ' A' ' 39' ' ' VAL . 3.2 pp -110.02 126.35 53.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.003 0.43 . . . . 0.0 110.754 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -44.33 122.78 3.16 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.641 -179.352 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.66 HG13 HD12 ' A' ' 37' ' ' LEU . 9.5 m -141.98 109.81 2.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.849 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.845 ' O ' HG22 ' A' ' 51' ' ' VAL . 4.9 p30 -125.32 95.73 4.57 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.046 -179.781 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.796 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -126.16 147.32 59.1 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.886 179.966 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.796 ' HD2' HG22 ' A' ' 41' ' ' THR . 57.3 Cg_exo -51.64 131.34 37.02 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.606 2.204 . . . . 0.0 112.36 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -141.06 -174.3 3.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.868 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 50.7 p -78.19 151.09 33.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.863 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.9 mmtt 65.7 -78.43 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.838 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 10.2 m170 -72.8 112.6 15.88 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.928 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.78 120.97 6.03 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.376 2.051 . . . . 0.0 112.377 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.9 160.62 31.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.85 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -170.98 44.06 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.925 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -84.34 -72.96 1.27 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.447 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.845 HG22 ' O ' ' A' ' 40' ' ' ASP . 9.9 m -75.87 170.09 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.736 0.303 . . . . 0.0 111.134 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -91.7 154.91 18.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.818 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.86 90.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.836 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -102.34 -31.5 10.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.94 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 77.43 -139.67 23.45 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.534 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -68.96 -10.23 28.58 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.571 2.181 . . . . 0.0 112.527 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -54.9 -34.47 63.12 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.796 0.332 . . . . 0.0 111.035 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.55 -49.93 75.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.106 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.7 t -77.73 -16.02 58.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.406 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -50.89 -29.52 12.17 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.827 0.346 . . . . 0.0 111.5 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.52 ' HB3' HD11 ' A' ' 92' ' ' ILE . 4.7 m-85 -57.48 -34.82 69.43 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.867 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.539 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 29.3 p -91.17 -15.29 29.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.215 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.428 ' O ' ' HB2' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -89.69 -56.96 3.04 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -179.264 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.8 tmtt? -89.18 -64.57 1.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.521 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.496 ' HA ' ' HB3' ' A' ' 69' ' ' ALA . 0.5 OUTLIER -59.43 -20.47 55.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.464 -178.311 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 66' ' ' TRP . . . . . 0.539 ' HB3' ' O ' ' A' ' 62' ' ' THR . 23.9 t90 -99.39 -33.83 10.54 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -179.067 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.428 ' HB2' ' O ' ' A' ' 63' ' ' LYS . 9.7 mm-40 -94.12 -53.57 3.91 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 -179.0 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -79.75 -28.32 40.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.654 0.264 . . . . 0.0 111.578 -178.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.496 ' HB3' ' HA ' ' A' ' 65' ' ' MET . . . -108.23 151.29 26.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.813 0.339 . . . . 0.0 111.23 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.1 mtmp? -97.94 94.83 7.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.274 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.511 ' HG3' ' HB1' ' A' ' 94' ' ' ALA . 0.0 OUTLIER -164.45 98.95 0.81 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.502 179.567 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.467 HG22 ' CD1' ' A' ' 66' ' ' TRP . 0.0 OUTLIER -133.48 127.48 53.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.12 179.864 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -162.87 158.26 22.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.735 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.604 HG11 HD13 ' A' ' 25' ' ' LEU . 7.3 m -133.54 152.52 35.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.145 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -157.54 93.55 1.3 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.864 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.56 ' CD1' ' HB2' ' A' ' 90' ' ' ALA . 42.0 p90 -143.13 118.11 10.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.155 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -91.91 91.9 8.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.606 179.683 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.482 ' HE3' HD13 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -94.52 -68.83 0.78 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.126 -179.719 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 64.13 27.31 71.27 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.352 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -129.18 116.05 18.61 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.977 0.418 . . . . 0.0 110.8 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.36 102.04 0.16 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.916 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.54 HG21 ' H ' ' A' ' 87' ' ' ARG . 26.7 m -58.77 149.12 27.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.44 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -115.74 -48.78 2.75 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -178.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.33 -63.17 0.58 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.309 -0.405 . . . . 0.0 112.049 -178.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -133.31 -35.33 1.03 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.788 0.328 . . . . 0.0 111.25 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.42 ' HA2' ' HB ' ' A' ' 82' ' ' THR . . . 120.55 34.61 0.92 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.816 -179.554 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.54 ' H ' HG21 ' A' ' 82' ' ' THR . 0.1 OUTLIER -138.89 120.38 15.02 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.104 0.478 . . . . 0.0 110.945 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -75.01 -140.16 0.7 Allowed Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 115.791 -0.64 . . . . 0.0 112.759 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.927 HD23 HD22 ' A' ' 36' ' ' LEU . 3.4 mp -128.46 116.01 19.05 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 122.109 0.163 . . . . 0.0 111.134 -179.409 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.818 ' O ' ' HA ' ' A' ' 35' ' ' ARG . . . -136.33 161.98 34.3 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 178.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.497 ' N ' ' CD1' ' A' ' 91' ' ' TYR . 0.0 OUTLIER -132.07 158.07 42.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.403 -178.874 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.52 HD11 ' HB3' ' A' ' 61' ' ' PHE . 2.4 pp -79.94 148.16 6.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.342 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -140.17 129.69 24.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.878 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.511 ' HB1' ' HG3' ' A' ' 71' ' ' LYS . . . -83.98 110.23 18.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.378 -179.755 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.501 ' N ' ' HB2' ' A' ' 71' ' ' LYS . 1.5 t70 60.72 20.22 10.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.685 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 64.66 122.92 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.518 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.7 tptm -93.58 107.06 18.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.759 0.314 . . . . 0.0 110.849 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.07 149.29 29.28 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.989 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.473 ' O ' HG23 ' A' ' 99' ' ' VAL . 18.0 m -142.99 69.9 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.094 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -99.19 161.75 13.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.902 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -129.06 30.95 4.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.948 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -125.29 83.18 2.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.155 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.453 ' N ' HD12 ' A' ' 103' ' ' LEU . 5.9 mp -102.83 125.73 49.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.889 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 104' ' ' VAL . 28.5 m -80.91 124.87 39.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.09 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.87 24.83 2.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.043 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 57.91 105.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.995 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 105.54 -132.66 11.22 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.501 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.71 74.9 0.18 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.834 0.349 . . . . 0.0 110.916 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.437 ' HB1' ' O ' ' A' ' 103' ' ' LEU . . . -120.09 121.18 38.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.033 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.128 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.921 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.86 0.362 . . . . 0.0 110.669 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.519 HD21 ' H ' ' A' ' 77' ' ' ASP . 1.5 pp -87.8 120.34 29.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.115 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -81.39 88.8 6.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.515 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.548 ' HE2' HG21 ' A' ' 74' ' ' VAL . 1.8 tttt -88.11 159.45 18.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.409 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.16 165.39 13.69 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.202 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.497 ' HB3' ' CG ' ' A' ' 73' ' ' GLU . 93.2 Cg_endo -77.55 163.14 29.81 Favored 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.347 2.031 . . . . 0.0 112.289 -178.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.663 ' HB3' HD23 ' A' ' 25' ' ' LEU . . . -115.56 -165.38 1.03 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.13 0.491 . . . . 0.0 111.716 -179.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.5 p -116.36 -174.89 2.64 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.06 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.515 HD22 ' O ' ' A' ' 62' ' ' THR . 61.1 tp -98.34 113.86 25.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.814 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 22.4 mm -125.18 -43.88 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.914 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.909 ' O ' HG13 ' A' ' 23' ' ' VAL . 6.3 tttt -142.12 141.54 32.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.716 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -127.01 119.32 26.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.153 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.931 HD12 HG23 ' A' ' 22' ' ' THR . 23.7 mt -150.61 152.88 11.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.096 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -68.6 76.8 0.29 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.893 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 48.51 74.05 0.29 Allowed Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.529 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.412 ' HB2' HG21 ' A' ' 18' ' ' ILE . 71.9 m-20 -147.8 -48.7 0.17 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.129 0.49 . . . . 0.0 110.575 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.931 HG23 HD12 ' A' ' 18' ' ' ILE . 1.3 t -169.87 106.57 0.35 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.676 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.909 HG13 ' O ' ' A' ' 16' ' ' LYS . 41.5 t -127.24 113.42 32.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.526 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.38 127.47 32.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.264 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.663 HD23 ' HB3' ' A' ' 12' ' ' ALA . 7.1 mp -114.6 139.06 49.92 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.334 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.86 99.39 2.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.914 0.388 . . . . 0.0 110.793 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -116.36 115.39 25.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.751 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.3 ttmp? 63.84 25.23 13.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.013 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 93.88 -13.97 66.29 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.642 -0.789 . . . . 0.0 112.884 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -112.3 139.45 22.55 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.835 0.318 . . . . 0.0 111.011 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -79.21 139.02 14.61 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.684 2.256 . . . . 0.0 112.419 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.485 ' HB3' ' CZ ' ' A' ' 34' ' ' PHE . 3.1 mmt -139.34 128.22 23.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.935 0.397 . . . . 0.0 111.029 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.485 HG21 ' OG1' ' A' ' 22' ' ' THR . 86.7 m -79.31 127.8 32.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.905 -179.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.989 ' CB ' ' HB3' ' A' ' 90' ' ' ALA . 38.0 m-85 -141.33 130.92 23.98 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.45 179.083 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -143.33 96.26 2.89 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.754 HD21 ' OD2' ' A' ' 83' ' ' ASP . 0.2 OUTLIER -144.34 87.29 1.87 Allowed 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.364 177.497 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.617 ' O ' HD23 ' A' ' 38' ' ' LEU . 0.6 OUTLIER -145.71 103.9 3.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.931 0.396 . . . . 0.0 111.267 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.617 HD23 ' O ' ' A' ' 37' ' ' LEU . 55.9 mt . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.006 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.428 ' HA ' ' CD2' ' A' ' 61' ' ' PHE . . . . . . . . 0 N--CA 1.462 0.142 0 CA-C-O 120.84 0.352 . . . . 0.0 111.412 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.2 p -54.0 -22.14 9.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.545 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -86.02 -31.2 22.13 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.861 0.362 . . . . 0.0 110.768 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.491 ' CA ' ' HB2' ' A' ' 65' ' ' MET . 19.0 m-30 -55.56 -30.59 61.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.743 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.583 ' HA ' ' HB2' ' A' ' 66' ' ' TRP . 0.0 OUTLIER -63.68 -14.79 55.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.549 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.7 mtpt -90.94 -68.36 0.8 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.139 0.495 . . . . 0.0 111.418 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.1 mttt -87.96 -51.49 5.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.084 -179.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.603 ' O ' ' HB3' ' A' ' 69' ' ' ALA . 2.1 mmt -63.63 -13.98 47.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.568 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . 0.583 ' HB2' ' HA ' ' A' ' 62' ' ' THR . 18.8 t90 -83.56 -34.96 25.09 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 121.392 0.615 . . . . 0.0 109.668 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -94.34 -22.99 17.99 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.118 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -114.1 -28.15 7.42 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.653 ' HB1' ' CB ' ' A' ' 95' ' ' ASP . . . -108.22 154.66 21.44 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.39 -178.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.505 ' O ' ' N ' ' A' ' 96' ' ' GLY . 0.0 OUTLIER -51.24 100.45 0.03 OUTLIER 'General case' 0 C--O 1.225 -0.188 0 CA-C-O 122.059 0.933 . . . . 0.0 108.676 -179.828 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.575 ' HB3' ' HA ' ' A' ' 66' ' ' TRP . 0.0 OUTLIER -84.97 174.41 9.79 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.312 -1.313 . . . . 0.0 114.019 -176.377 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.826 HG21 HG23 ' A' ' 92' ' ' ILE . 23.1 pt -63.96 141.05 18.69 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.21 0 CA-C-O 122.278 1.037 . . . . 0.0 113.757 -175.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.497 ' CG ' ' HB3' ' A' ' 11' ' ' PRO . 41.2 mt-10 -158.78 157.57 31.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 113.371 -1.741 . . . . 0.0 107.927 179.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.548 HG21 ' HE2' ' A' ' 9' ' ' LYS . 1.7 p -100.85 145.12 11.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.359 -0.536 . . . . 0.0 111.073 -179.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.412 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -125.79 -69.25 0.79 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.534 -179.197 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.412 ' CD1' ' HB3' ' A' ' 75' ' ' GLU . 12.6 p90 -138.67 156.4 47.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.947 0.403 . . . . 0.0 111.236 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.519 ' H ' HD21 ' A' ' 7' ' ' LEU . 6.3 m-20 -104.03 158.47 16.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.823 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.9 tptt -87.42 -40.72 14.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.044 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 106.02 26.46 6.04 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.573 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -118.56 -40.47 2.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.907 0.384 . . . . 0.0 110.701 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.749 ' HA ' HD22 ' A' ' 89' ' ' LEU . 0.0 OUTLIER 80.04 -54.76 0.38 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.191 179.848 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.551 HG22 ' HG3' ' A' ' 81' ' ' ARG . 1.3 t -110.04 120.61 43.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.651 0.262 . . . . 0.0 111.078 179.555 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.754 ' OD2' HD21 ' A' ' 36' ' ' LEU . 0.2 OUTLIER -115.54 -51.58 2.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.261 179.893 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.34 -63.22 1.41 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.195 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -103.51 -35.2 8.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.898 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . 0.483 ' HA2' ' CB ' ' A' ' 82' ' ' THR . . . 108.61 51.09 0.72 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.005 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 61.5 mtt-85 -130.43 97.85 4.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.909 0.385 . . . . 0.0 111.208 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.425 ' HA3' ' O ' ' A' ' 33' ' ' THR . . . 53.01 168.38 0.02 OUTLIER Glycine 0 C--N 1.331 0.255 0 CA-C-N 115.919 -0.582 . . . . 0.0 113.136 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.749 HD22 ' HA ' ' A' ' 81' ' ' ARG . 1.0 OUTLIER -128.74 97.93 4.83 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.542 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.989 ' HB3' ' CB ' ' A' ' 34' ' ' PHE . . . -165.46 148.0 7.75 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.064 0.459 . . . . 0.0 111.659 178.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.662 ' N ' ' CD1' ' A' ' 91' ' ' TYR . 0.1 OUTLIER -92.5 136.96 32.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.906 -177.665 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.848 HD11 ' O ' ' A' ' 34' ' ' PHE . 2.5 mp -89.52 109.62 20.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.318 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.626 ' N ' HG22 ' A' ' 72' ' ' ILE . 3.5 m-85 -88.41 117.49 27.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.86 0.362 . . . . 0.0 110.613 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -113.47 121.26 43.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.914 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.653 ' CB ' ' HB1' ' A' ' 69' ' ' ALA . 4.6 p-10 44.78 44.56 7.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.078 0.466 . . . . 0.0 110.838 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 70' ' ' LYS . . . . . . . . 0 CA--C 1.52 0.365 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.931 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.118 0 CA-C-O 120.818 0.342 . . . . 0.0 111.014 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.95 HD21 ' CG ' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -84.06 151.08 25.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.72 -179.997 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . 0.718 ' H ' HD13 ' A' ' 7' ' ' LEU . 7.3 m80 -117.81 136.56 53.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.934 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -116.94 116.25 27.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.953 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.431 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 0.4 OUTLIER -155.14 145.48 15.95 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.159 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.549 ' HB3' HG21 ' A' ' 72' ' ' ILE . 73.7 Cg_endo -78.44 141.1 17.62 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.14 1.893 . . . . 0.0 112.526 -179.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.839 ' O ' HD11 ' A' ' 72' ' ' ILE . . . -115.32 -165.42 1.03 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.031 -179.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.442 HG22 ' H ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -120.03 -168.86 1.68 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.976 0.417 . . . . 0.0 111.276 -179.501 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.442 ' H ' HG22 ' A' ' 13' ' ' THR . 0.9 OUTLIER -53.86 157.27 2.45 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.417 -179.746 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.462 ' CG2' ' HB3' ' A' ' 25' ' ' LEU . 1.2 pp -112.03 -179.12 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.089 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.76 172.97 6.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.837 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.761 ' O ' HD13 ' A' ' 18' ' ' ILE . . . -106.47 126.81 52.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.116 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.761 HD13 ' O ' ' A' ' 17' ' ' ALA . 19.7 mm -141.41 158.17 21.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.214 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.471 ' N ' HG22 ' A' ' 18' ' ' ILE . 12.9 p-10 -72.96 66.42 0.79 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.81 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 160.88 -130.55 2.39 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.361 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.525 ' O ' HG13 ' A' ' 23' ' ' VAL . 52.0 m-20 -113.09 -15.26 12.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.696 0.284 . . . . 0.0 110.887 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.548 ' OG1' HG21 ' A' ' 18' ' ' ILE . 31.1 p -54.6 109.08 0.45 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.97 0.414 . . . . 0.0 111.424 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.617 ' O ' HD23 ' A' ' 25' ' ' LEU . 35.3 m -122.73 118.89 56.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.619 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.86 106.49 16.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.492 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.663 HD11 ' CD ' ' A' ' 75' ' ' GLU . 0.3 OUTLIER -118.76 164.95 14.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.593 179.513 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 2.4 ttp -79.95 99.8 7.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.567 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.425 ' CD1' ' HB2' ' A' ' 28' ' ' LYS . 51.1 t80 -124.27 133.43 53.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.998 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.425 ' HB2' ' CD1' ' A' ' 27' ' ' TYR . 0.0 OUTLIER 57.37 28.68 15.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.93 179.988 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.54 4.91 85.48 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.941 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -136.78 143.9 44.61 Favored Pre-proline 0 C--N 1.332 -0.163 0 CA-C-N 116.737 0.269 . . . . 0.0 111.008 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.39 130.12 14.68 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.523 2.148 . . . . 0.0 112.28 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.441 ' HB2' ' CE2' ' A' ' 34' ' ' PHE . 8.3 mtt -139.67 134.24 31.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.004 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.54 129.3 35.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.834 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.774 ' CB ' ' HB2' ' A' ' 90' ' ' ALA . 60.8 m-85 -138.73 158.23 44.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.972 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.562 ' C ' ' HB3' ' A' ' 90' ' ' ALA . 16.0 ptt180 -102.43 120.86 41.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.763 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.897 HD12 HG23 ' A' ' 92' ' ' ILE . 3.3 mm? -44.57 151.52 0.27 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.239 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.471 ' O ' HD23 ' A' ' 38' ' ' LEU . 3.9 pp -59.52 138.24 57.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.029 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.471 HD23 ' O ' ' A' ' 37' ' ' LEU . 27.4 mt . . . . . 0 C--N 1.328 -0.359 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.803 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.087 0 CA-C-O 120.902 0.382 . . . . 0.0 111.024 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.2 p -63.5 -28.61 70.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.956 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -55.13 -26.15 36.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.312 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -57.17 -31.53 65.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.076 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.485 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 44.6 p -87.11 -21.77 25.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.11 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.484 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 5.0 mtmt -89.18 -19.99 24.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.206 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.76 -64.26 1.17 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.779 -179.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 9.9 mmm -89.16 -52.97 4.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.8 -178.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . 0.485 ' HB3' ' O ' ' A' ' 62' ' ' THR . 83.5 t90 -62.11 -15.54 46.11 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.484 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 22.4 tt0 -89.57 -51.97 5.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.799 0.333 . . . . 0.0 111.15 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -80.02 -28.15 39.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.146 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -108.07 150.91 26.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.837 0.351 . . . . 0.0 111.186 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.8 mtpt -98.28 96.46 8.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.828 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.23 125.11 22.62 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.207 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.839 HD11 ' O ' ' A' ' 12' ' ' ALA . 0.3 OUTLIER -88.01 154.1 3.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.264 179.263 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -134.28 151.36 51.23 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.431 ' HB ' ' O ' ' A' ' 10' ' ' GLU . 7.5 p -126.47 153.22 34.86 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.7 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.663 ' CD ' HD11 ' A' ' 25' ' ' LEU . 2.5 mp0 -100.98 166.86 10.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.904 0.383 . . . . 0.0 111.166 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.95 ' CG ' HD21 ' A' ' 7' ' ' LEU . 6.3 m-30 -93.0 168.1 11.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.875 -179.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -96.89 91.91 5.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.715 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.706 ' HG3' HD12 ' A' ' 89' ' ' LEU . 0.1 OUTLIER -77.85 -28.14 50.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.96 -179.877 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 68.21 25.17 74.68 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.38 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.06 84.49 2.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.876 0.369 . . . . 0.0 110.587 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 61.0 ttt180 -50.95 100.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.07 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.703 HG21 ' C ' ' A' ' 87' ' ' ARG . 7.4 p -58.79 120.9 9.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.596 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -115.31 -45.44 2.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.374 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.09 -50.33 11.11 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.198 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -133.0 -35.04 1.07 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.233 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 97.73 46.87 2.21 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.815 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.703 ' C ' HG21 ' A' ' 82' ' ' THR . 21.9 mtm180 -133.47 99.16 4.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.837 0.351 . . . . 0.0 111.307 -179.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -85.07 -121.46 1.03 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.371 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.706 HD12 ' HG3' ' A' ' 78' ' ' LYS . 6.2 mt -128.18 128.19 44.32 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.843 0.354 . . . . 0.0 110.965 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.774 ' HB2' ' CB ' ' A' ' 34' ' ' PHE . . . -111.56 148.67 32.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.263 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.51 ' CZ ' ' CG ' ' A' ' 76' ' ' PHE . 1.6 m-85 -137.07 158.28 44.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.339 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.897 HG23 HD12 ' A' ' 36' ' ' LEU . 2.0 pp -124.85 111.75 29.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.862 0.363 . . . . 0.0 111.623 -179.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -98.71 134.44 41.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.602 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.47 110.84 22.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.286 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.2 t0 47.82 30.47 1.91 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.168 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.396 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.352 -179.926 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.069 0 CA-C-O 120.845 0.355 . . . . 0.0 111.069 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.458 HD22 ' O ' ' A' ' 75' ' ' GLU . 2.9 pp -73.1 157.0 38.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.958 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 5.2 m170 -80.07 124.81 29.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.711 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 ptpt -101.09 107.73 19.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.939 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -155.14 120.84 2.62 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.796 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.414 ' N ' ' HG2' ' A' ' 73' ' ' GLU . 84.2 Cg_endo -78.72 146.81 21.4 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.299 1.999 . . . . 0.0 112.124 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.814 ' HB1' ' O ' ' A' ' 26' ' ' MET . . . -127.83 -86.78 0.57 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.347 -179.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.657 HG23 ' O ' ' A' ' 12' ' ' ALA . 0.1 OUTLIER 167.57 119.77 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.678 0.275 . . . . 0.0 110.991 -179.908 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.725 ' HA ' HD12 ' A' ' 25' ' ' LEU . 10.9 tp -85.8 155.84 20.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.202 179.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.768 HD11 ' HG3' ' A' ' 26' ' ' MET . 12.7 mt -125.2 -72.34 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -120.23 146.51 45.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.893 0.377 . . . . 0.0 111.289 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.865 ' HA ' HG12 ' A' ' 23' ' ' VAL . . . -127.1 97.94 5.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.941 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.593 HD11 ' CB ' ' A' ' 21' ' ' ASP . 5.7 pt -64.62 -164.23 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.108 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -69.14 63.4 0.13 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.644 0.259 . . . . 0.0 111.499 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 42.58 70.21 0.52 Allowed Glycine 0 CA--C 1.519 0.289 0 C-N-CA 121.23 -0.51 . . . . 0.0 113.295 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.593 ' CB ' HD11 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -147.09 -39.57 0.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.592 0.234 . . . . 0.0 111.128 179.818 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.7 t -169.5 120.74 0.7 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.867 0.365 . . . . 0.0 111.144 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.865 HG12 ' HA ' ' A' ' 17' ' ' ALA . 33.6 m -117.66 131.73 69.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.885 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.403 ' HB3' ' HB ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -79.13 147.35 32.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.924 0.392 . . . . 0.0 111.209 -179.572 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.725 HD12 ' HA ' ' A' ' 14' ' ' LEU . 2.1 tp -141.01 125.37 17.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.82 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.814 ' O ' ' HB1' ' A' ' 12' ' ' ALA . 7.7 mtt -72.92 99.82 2.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.821 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -125.67 126.94 45.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.965 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.53 33.23 20.65 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.085 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.21 20.67 73.35 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.457 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.412 ' HA ' ' HD3' ' A' ' 31' ' ' PRO . 8.3 mt-30 -134.66 119.71 14.08 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.542 0.21 . . . . 0.0 110.84 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 30' ' ' GLN . 34.1 Cg_exo -59.72 133.52 51.77 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.401 2.067 . . . . 0.0 112.431 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.608 ' HB3' ' CE2' ' A' ' 34' ' ' PHE . 15.2 mmt -132.33 110.16 10.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.155 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.602 HG23 ' O ' ' A' ' 33' ' ' THR . 8.8 t -120.69 86.3 2.55 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -179.125 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.608 ' CE2' ' HB3' ' A' ' 32' ' ' MET . 1.7 p90 -142.09 106.26 4.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.438 177.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.641 ' HG3' ' HB1' ' A' ' 90' ' ' ALA . 13.4 ttp180 -140.55 97.08 3.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.634 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.926 HD11 ' HA2' ' A' ' 88' ' ' GLY . 0.5 OUTLIER -142.54 88.78 2.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.894 0.378 . . . . 0.0 110.75 178.971 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.732 ' C ' HD13 ' A' ' 38' ' ' LEU . 0.9 OUTLIER -133.03 93.73 3.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.794 180.0 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.732 HD13 ' C ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.841 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.101 0 CA-C-O 120.836 0.35 . . . . 0.0 111.249 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.3 m -62.35 -30.8 71.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.089 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.62 -30.47 71.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.232 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 35.3 t80 -71.97 -42.07 66.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.041 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.432 ' CA ' ' HB3' ' A' ' 66' ' ' TRP . 81.1 p -76.11 -48.82 19.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.928 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.473 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -53.8 -21.33 7.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.442 -179.949 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.51 -60.86 1.85 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.301 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.491 ' O ' ' HB3' ' A' ' 69' ' ' ALA . 18.9 mtm -90.12 -51.97 5.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.91 -179.145 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . 0.652 ' CE2' HD23 ' A' ' 14' ' ' LEU . 64.3 t90 -59.99 -33.0 71.38 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -178.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.473 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -74.44 -50.19 19.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.741 0.305 . . . . 0.0 111.659 -179.365 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -79.8 -28.67 40.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.429 -179.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 65' ' ' MET . . . -108.47 148.5 30.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.224 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.9 mmmm -104.25 92.81 4.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.45 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -140.4 98.81 3.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.974 -179.776 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.671 HD13 ' N ' ' A' ' 72' ' ' ILE . 0.0 OUTLIER -139.66 131.44 33.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.18 0.514 . . . . 0.0 111.767 179.883 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.415 ' HB2' ' CG ' ' A' ' 93' ' ' TYR . 0.2 OUTLIER -165.18 178.97 6.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.014 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.7 t -100.9 136.36 32.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.756 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.458 ' O ' HD22 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -130.84 -5.91 4.02 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -179.363 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.687 ' HB2' HD23 ' A' ' 89' ' ' LEU . 2.7 p90 -92.14 137.86 32.01 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.129 0.49 . . . . 0.0 111.771 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.506 ' C ' HD22 ' A' ' 89' ' ' LEU . 9.2 p-10 -104.58 91.83 4.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.229 179.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.485 ' HA ' HD13 ' A' ' 89' ' ' LEU . 1.8 tptp -78.41 -71.93 0.4 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.193 -179.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 95.62 -27.74 14.77 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.244 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.9 -163.35 0.47 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.622 0.248 . . . . 0.0 110.568 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -119.1 18.27 13.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.474 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 16.4 p -109.07 120.04 41.34 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.909 0.385 . . . . 0.0 111.011 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.555 ' O ' ' HB3' ' A' ' 87' ' ' ARG . 4.7 m-20 -116.92 -52.15 2.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.316 0.579 . . . . 0.0 109.665 178.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 4.5 mtpt -111.19 -32.94 6.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.675 178.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 46.0 m-85 -87.69 46.48 1.38 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.884 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 130.44 44.04 0.18 Allowed Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.951 -0.642 . . . . 0.0 111.57 -179.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.555 ' HB3' ' O ' ' A' ' 83' ' ' ASP . 0.0 OUTLIER -57.8 132.97 54.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.137 0.494 . . . . 0.0 110.229 179.394 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.926 ' HA2' HD11 ' A' ' 36' ' ' LEU . . . -129.92 -35.72 0.42 Allowed Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.703 -0.761 . . . . 0.0 113.538 -179.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.687 HD23 ' HB2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER -103.46 148.47 25.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.819 0.342 . . . . 0.0 111.554 -179.14 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.78 ' HB2' ' N ' ' A' ' 36' ' ' LEU . . . -118.62 147.19 44.0 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.435 0.532 . . . . 0.0 112.435 -179.105 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -116.04 144.99 43.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.016 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.568 HG23 ' O ' ' A' ' 92' ' ' ILE . 1.3 tt -150.11 113.57 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.84 179.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.415 ' CG ' ' HB2' ' A' ' 73' ' ' GLU . 7.8 t80 -108.07 123.44 48.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.069 0.462 . . . . 0.0 111.156 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.414 ' HA ' ' HG3' ' A' ' 71' ' ' LYS . . . -134.18 91.8 2.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.158 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 38.4 t70 50.39 58.07 5.9 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.484 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.764 179.769 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.457 -0.092 0 CA-C-O 120.891 0.377 . . . . 0.0 110.93 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.605 HD22 ' C ' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -70.05 157.13 38.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.93 -179.863 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -79.71 155.04 28.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.707 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.79 132.17 39.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.185 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.436 ' O ' HG23 ' A' ' 74' ' ' VAL . 7.1 tt0 -155.03 120.13 2.59 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.767 179.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -80.27 170.96 15.57 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.507 2.138 . . . . 0.0 112.685 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 1.065 ' HB3' HD23 ' A' ' 25' ' ' LEU . . . -136.57 -80.3 0.4 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.742 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.953 HG23 HD13 ' A' ' 72' ' ' ILE . 3.8 m 90.43 -69.36 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.651 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.49 87.02 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.818 0.342 . . . . 0.0 111.272 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.766 HG22 ' HA ' ' A' ' 25' ' ' LEU . 2.6 pp -125.48 -179.1 2.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.114 0.483 . . . . 0.0 111.726 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.9 mtpt -133.31 173.01 11.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.26 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -93.87 130.27 39.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.873 0.368 . . . . 0.0 111.255 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.616 HG21 ' CG2' ' A' ' 22' ' ' THR . 3.5 mp -140.34 157.98 25.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.974 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.462 ' N ' HG22 ' A' ' 18' ' ' ILE . 0.3 OUTLIER -98.03 146.52 25.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.975 -179.939 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.18 -129.95 10.11 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.519 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -126.16 89.32 3.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.728 0.299 . . . . 0.0 110.858 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.616 ' CG2' HG21 ' A' ' 18' ' ' ILE . 8.8 t -174.15 136.4 0.5 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.048 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.7 m -142.32 117.98 5.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.128 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.733 ' O ' HG22 ' A' ' 15' ' ' ILE . 1.4 tttp -79.68 97.68 6.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.444 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 1.065 HD23 ' HB3' ' A' ' 12' ' ' ALA . 0.4 OUTLIER -97.7 145.36 26.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.363 179.277 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.767 ' N ' ' HB1' ' A' ' 12' ' ' ALA . 14.2 ttt -72.86 99.32 2.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.922 0.392 . . . . 0.0 110.718 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -105.11 94.93 5.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.855 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 65.1 tttt 53.99 29.95 10.94 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.982 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 82.47 22.01 59.25 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.585 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -124.67 122.37 25.72 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-O 120.484 0.183 . . . . 0.0 110.753 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.61 127.53 23.97 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.416 2.077 . . . . 0.0 112.394 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.519 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 1.4 ptm -139.55 110.11 6.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.586 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.523 HG23 ' N ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -114.84 94.37 4.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.891 0.377 . . . . 0.0 111.51 -179.653 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 1.067 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 2.2 m-85 -141.14 143.34 34.21 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.11 0.481 . . . . 0.0 110.133 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.438 ' HA ' ' O ' ' A' ' 90' ' ' ALA . 6.3 ttt180 -143.63 98.12 3.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.013 -0.54 . . . . 0.0 112.063 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.635 HD22 HD22 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -142.72 88.68 2.08 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.318 178.91 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.671 ' O ' HD12 ' A' ' 37' ' ' LEU . 1.1 pp -125.89 84.04 2.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.783 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.843 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.369 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.546 ' O ' ' N ' ' A' ' 61' ' ' PHE . 89.4 p -100.59 -14.75 18.05 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 113.009 -1.905 . . . . 0.0 114.141 -178.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -37.0 -16.2 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -175.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.546 ' N ' ' O ' ' A' ' 59' ' ' SER . 5.6 t80 -52.63 -42.4 64.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 118.416 0.553 . . . . 0.0 111.379 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.446 ' HA ' ' HB2' ' A' ' 66' ' ' TRP . 32.9 p -82.38 -43.14 17.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.85 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.05 -20.12 15.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.507 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 44.8 mmtt -86.84 -63.73 1.26 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.768 0.318 . . . . 0.0 111.187 -179.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 2.8 ttp -89.27 -55.31 3.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.197 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . 0.861 ' CZ2' HG23 ' A' ' 72' ' ' ILE . 0.6 OUTLIER -51.4 -26.64 8.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.57 -179.738 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -94.06 -36.77 11.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.44 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -79.98 -28.15 39.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.347 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.649 ' HB3' ' HD3' ' A' ' 71' ' ' LYS . . . -108.3 150.97 26.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.094 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.31 92.96 9.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.009 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.649 ' HD3' ' HB3' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -160.35 98.86 1.29 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.923 179.936 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.953 HD13 HG23 ' A' ' 13' ' ' THR . 1.6 mp -136.05 130.96 49.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.963 0.411 . . . . 0.0 111.462 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -151.76 157.0 41.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.671 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.981 HG13 HD22 ' A' ' 25' ' ' LEU . 0.6 OUTLIER -136.17 153.08 31.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.933 0.397 . . . . 0.0 111.194 -179.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.584 ' HA ' HD11 ' A' ' 7' ' ' LEU . 1.8 mt-10 -163.55 78.66 0.42 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.701 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.605 ' C ' HD22 ' A' ' 7' ' ' LEU . 26.3 p90 -142.7 158.86 43.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.148 0.499 . . . . 0.0 111.523 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.23 162.76 4.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.411 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 67.3 mttt -50.55 -26.88 5.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.243 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.2 40.97 54.85 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.813 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -91.32 51.0 1.83 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.956 0.408 . . . . 0.0 110.799 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -122.68 -39.19 2.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.123 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.838 HG21 ' O ' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -59.44 122.2 13.39 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.078 0.466 . . . . 0.0 111.047 -179.827 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -115.46 -47.76 2.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.86 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.61 -61.06 2.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.113 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -80.97 -35.47 32.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.155 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.76 25.59 52.7 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.082 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.838 ' O ' HG21 ' A' ' 82' ' ' THR . 4.3 mtp85 -131.97 107.07 8.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.849 0.356 . . . . 0.0 110.645 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.472 ' O ' ' O ' ' A' ' 87' ' ' ARG . . . -54.29 -150.71 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.228 0 CA-C-N 115.736 -0.665 . . . . 0.0 113.125 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.635 HD22 HD22 ' A' ' 36' ' ' LEU . 0.5 OUTLIER -128.32 132.92 48.62 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 122.778 -0.248 . . . . 0.0 111.377 -179.223 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 1.067 ' HB3' ' O ' ' A' ' 34' ' ' PHE . . . -128.76 154.84 45.98 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 120.35 -0.54 . . . . 0.0 112.134 178.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.468 ' CD1' ' O ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -117.8 127.12 53.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.81 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 8.6 pt -79.9 130.85 35.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.129 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -117.58 117.93 30.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.836 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.41 104.58 16.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.051 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.404 ' CA ' ' HB2' ' A' ' 71' ' ' LYS . 0.4 OUTLIER 64.63 36.31 8.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.946 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 0.222 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.625 179.92 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.457 -0.093 0 CA-C-O 120.712 0.291 . . . . 0.0 110.74 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.5 mt -120.02 113.78 21.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.313 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 40.2 m-70 -71.59 99.9 2.17 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.38 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.813 ' HG3' HG23 ' A' ' 74' ' ' VAL . 5.7 mmtp -118.3 158.82 24.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.355 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -104.22 164.68 14.81 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.232 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.417 ' HA ' ' O ' ' A' ' 72' ' ' ILE . 86.6 Cg_endo -78.03 106.11 2.11 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.31 2.006 . . . . 0.0 112.857 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.513 ' O ' ' OG1' ' A' ' 13' ' ' THR . . . -158.19 124.5 4.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.389 179.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.711 ' HA ' ' HB3' ' A' ' 25' ' ' LEU . 76.1 m -176.31 24.88 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.888 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.535 ' O ' HD13 ' A' ' 15' ' ' ILE . 0.7 OUTLIER -98.09 83.81 3.17 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.013 -0.675 . . . . 0.0 110.06 178.983 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.535 HD13 ' O ' ' A' ' 14' ' ' LEU . 2.1 mm -127.63 -70.88 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.395 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt -145.61 140.98 27.76 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.933 179.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.86 133.84 39.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.966 0.413 . . . . 0.0 111.622 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.482 HG22 ' N ' ' A' ' 19' ' ' ASP . 16.5 mt -153.16 159.31 3.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.781 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.482 ' N ' HG22 ' A' ' 18' ' ' ILE . 0.5 OUTLIER -67.76 172.25 5.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.864 0.364 . . . . 0.0 111.042 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.466 ' CA ' ' HB2' ' A' ' 36' ' ' LEU . . . -69.73 65.85 0.63 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.835 -0.697 . . . . 0.0 112.472 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -148.18 -52.16 0.18 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.041 0.448 . . . . 0.0 110.143 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.477 HG23 HG21 ' A' ' 18' ' ' ILE . 0.7 OUTLIER -143.19 106.48 4.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.818 179.768 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.475 HG22 ' HB ' ' A' ' 18' ' ' ILE . 23.2 t -130.78 128.09 62.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.324 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.449 ' C ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -92.59 144.35 25.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.183 0.516 . . . . 0.0 111.944 -179.093 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.897 HD11 ' CE1' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -132.28 165.33 24.42 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.986 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.436 ' N ' HD11 ' A' ' 15' ' ' ILE . 6.7 mtt -77.18 98.62 5.15 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.446 ' HB2' HD23 ' A' ' 25' ' ' LEU . 5.6 t80 -128.17 113.94 16.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.074 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 52.01 26.25 3.63 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.95 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.31 13.82 76.92 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.779 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -124.86 140.88 36.73 Favored Pre-proline 0 C--N 1.332 -0.16 0 CA-C-O 120.666 0.27 . . . . 0.0 111.024 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -68.16 135.78 35.56 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.481 2.12 . . . . 0.0 111.973 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.741 ' SD ' HD21 ' A' ' 89' ' ' LEU . 2.5 mmt -145.11 110.46 5.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.244 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.715 ' O ' HD23 ' A' ' 89' ' ' LEU . 61.9 p -77.02 131.04 38.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.16 0.505 . . . . 0.0 112.277 -179.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.897 ' CE1' HD11 ' A' ' 25' ' ' LEU . 2.3 m-30 -106.57 158.73 16.71 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.976 179.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -115.64 148.08 40.07 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.348 179.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.55 ' HA ' ' HB3' ' A' ' 91' ' ' TYR . 0.1 OUTLIER -104.45 134.64 47.3 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.088 0.47 . . . . 0.0 111.682 -179.364 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.8 tp -144.25 133.74 23.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.618 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.281 0 CA-C-O 120.812 0.339 . . . . 0.0 111.053 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.044 0 CA-C-O 120.876 0.369 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.35 -38.54 89.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.832 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.51 -32.07 73.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.016 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.403 ' CZ ' ' HB3' ' A' ' 94' ' ' ALA . 0.2 OUTLIER -59.34 -51.78 68.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.641 179.905 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.441 ' HB ' ' HB3' ' A' ' 66' ' ' TRP . 51.4 p -58.2 -45.54 87.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.783 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.402 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 1.9 tttm -54.92 -19.83 7.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.34 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.19 -63.38 1.31 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.935 0.398 . . . . 0.0 111.204 -179.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.5 ' O ' ' N ' ' A' ' 69' ' ' ALA . 2.1 mtt -87.93 -58.87 2.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.223 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . 0.441 ' HB3' ' HB ' ' A' ' 62' ' ' THR . 74.9 t90 -51.55 -32.0 26.54 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.402 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 0.5 OUTLIER -94.44 -52.66 4.23 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -179.168 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -79.47 -28.29 41.54 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.746 0.308 . . . . 0.0 111.625 -178.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 65' ' ' MET . . . -107.69 151.21 25.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.597 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.2 mtmt -103.41 97.25 7.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.844 0.354 . . . . 0.0 111.94 -178.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.455 ' HD3' ' CB ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -166.25 96.63 0.59 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.712 178.79 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.634 HG21 ' CB ' ' A' ' 13' ' ' THR . 1.3 mp -141.47 103.83 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.148 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -136.84 151.43 49.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.845 0.355 . . . . 0.0 111.796 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.813 HG23 ' HG3' ' A' ' 9' ' ' LYS . 2.0 m -103.81 153.63 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.793 -179.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.56 -75.41 0.61 Allowed 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.989 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -143.39 146.33 33.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.852 0.358 . . . . 0.0 111.007 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.909 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 1.9 p30 -59.12 148.29 31.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.093 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.411 ' NZ ' ' HB2' ' A' ' 80' ' ' GLN . 0.2 OUTLIER -101.2 -61.35 1.38 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.835 179.872 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 100.89 41.17 2.71 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.884 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.411 ' HB2' ' NZ ' ' A' ' 78' ' ' LYS . 2.8 mt-30 -123.97 150.77 44.41 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.855 0.36 . . . . 0.0 110.922 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 69.1 9.97 7.64 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.24 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.473 ' CB ' ' O ' ' A' ' 85' ' ' TYR . 0.5 OUTLIER -109.3 148.42 31.06 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.658 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -84.69 -52.57 5.98 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.073 0.463 . . . . 0.0 110.079 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.9 mttt -110.51 -57.29 2.24 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 177.065 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.737 ' O ' ' N ' ' A' ' 87' ' ' ARG . 65.9 m-85 -133.35 -37.7 0.95 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 113.879 -1.51 . . . . 0.0 107.985 176.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . 0.454 ' HA3' ' HB ' ' A' ' 82' ' ' THR . . . 44.28 -36.71 0.0 OUTLIER Glycine 0 N--CA 1.472 1.086 0 C-N-CA 125.188 1.375 . . . . 0.0 115.662 177.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.737 ' N ' ' O ' ' A' ' 85' ' ' TYR . 0.1 OUTLIER -142.69 95.88 2.85 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 176.912 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.813 ' C ' HD13 ' A' ' 89' ' ' LEU . . . -77.42 13.03 12.04 Favored Glycine 0 C--N 1.313 -0.75 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.179 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.813 HD13 ' C ' ' A' ' 88' ' ' GLY . 0.0 OUTLIER -128.2 149.81 50.29 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 122.787 0.435 . . . . 0.0 110.229 -179.17 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.909 ' HB2' ' HA ' ' A' ' 77' ' ' ASP . . . -101.49 -178.31 3.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.023 0.44 . . . . 0.0 111.861 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.55 ' HB3' ' HA ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -71.97 145.69 48.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.834 -178.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.67 ' O ' HD12 ' A' ' 92' ' ' ILE . 1.3 pp -96.55 160.31 2.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.99 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -110.91 119.13 38.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.013 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.403 ' HB3' ' CZ ' ' A' ' 61' ' ' PHE . . . -97.44 93.74 6.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.082 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.416 ' N ' ' HG3' ' A' ' 71' ' ' LYS . 12.3 t0 67.05 52.46 0.87 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.873 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.405 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.598 179.85 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.7 mtpt . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.882 0.372 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.665 HD13 ' H ' ' A' ' 8' ' ' HIS . 0.2 OUTLIER -108.07 153.98 22.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.827 179.812 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . 0.665 ' H ' HD13 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -93.48 147.24 23.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.864 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.27 122.76 21.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.103 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -146.11 131.64 9.28 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.514 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.568 ' HA ' ' HA ' ' A' ' 73' ' ' GLU . 84.8 Cg_endo -79.75 171.13 16.0 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.293 1.995 . . . . 0.0 112.732 -179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -153.65 -136.18 0.06 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.717 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.788 HG22 ' HB2' ' A' ' 26' ' ' MET . 3.5 t -162.24 178.44 8.73 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.743 0.306 . . . . 0.0 110.799 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.645 HD13 ' N ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -97.16 94.82 7.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.988 0.423 . . . . 0.0 111.076 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.9 mt -85.84 -68.63 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.007 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.418 ' HB2' ' CG ' ' A' ' 24' ' ' LYS . 4.4 ttpp -110.05 169.74 8.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.472 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -87.12 148.31 25.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.049 0.452 . . . . 0.0 111.85 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.883 HD11 ' HG3' ' A' ' 35' ' ' ARG . 5.9 tp -111.35 119.04 58.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.156 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -118.24 28.93 8.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.835 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.38 38.17 29.65 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.345 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -147.12 -49.47 0.19 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.747 0.308 . . . . 0.0 110.834 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 71.8 p -157.97 139.58 13.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.17 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.767 ' HB ' HD13 ' A' ' 18' ' ' ILE . 12.5 p -142.43 114.05 3.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.693 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.418 ' CG ' ' HB2' ' A' ' 16' ' ' LYS . 4.4 ptpt -91.02 125.98 35.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.386 -179.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 21.6 mt -124.49 157.0 36.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.606 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.788 ' HB2' HG22 ' A' ' 13' ' ' THR . 0.0 OUTLIER -72.99 99.89 2.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.905 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.615 ' CD2' HG21 ' A' ' 74' ' ' VAL . 24.9 t80 -124.37 108.47 12.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.705 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 62.7 23.75 14.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.036 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 89.96 -14.14 62.73 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.92 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -110.66 144.82 31.03 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.838 0.319 . . . . 0.0 111.089 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -73.6 151.65 47.27 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.513 2.142 . . . . 0.0 112.199 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.456 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 1.7 mmm -145.15 113.77 6.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.093 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 37.2 p -89.81 86.68 6.72 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.411 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.457 ' HB2' ' O ' ' A' ' 88' ' ' GLY . 1.9 p90 -141.31 118.76 11.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.071 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.883 ' HG3' HD11 ' A' ' 18' ' ' ILE . 0.0 OUTLIER -139.89 120.27 13.98 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.347 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.736 HD13 HD13 ' A' ' 89' ' ' LEU . 0.4 OUTLIER -143.11 146.51 33.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.12 178.201 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.428 HD23 ' N ' ' A' ' 37' ' ' LEU . 0.5 OUTLIER -144.17 135.08 25.21 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.935 0.398 . . . . 0.0 111.27 -179.932 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.7 tt . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.772 179.9 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.813 0.339 . . . . 0.0 110.966 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.6 p -62.07 -19.11 62.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.123 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -51.3 -29.06 13.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.771 0.32 . . . . 0.0 111.418 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -60.18 -63.87 1.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.809 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.447 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 0.6 OUTLIER -66.92 -34.79 78.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.749 -179.978 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.418 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 13.2 mttm -51.15 -19.85 1.31 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.627 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -81.02 -61.85 1.84 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.83 0.347 . . . . 0.0 111.013 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.443 ' O ' ' N ' ' A' ' 69' ' ' ALA . 5.7 mmt -88.68 -52.56 5.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.964 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . 0.447 ' HB3' ' O ' ' A' ' 62' ' ' THR . 68.2 t90 -53.66 -27.37 27.07 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.69 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.418 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -94.51 -56.42 2.81 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.315 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -79.88 -28.4 39.91 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 65' ' ' MET . . . -104.59 144.08 32.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.826 0.346 . . . . 0.0 110.866 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -96.59 92.6 6.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.153 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.464 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -162.06 98.11 1.05 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.015 179.536 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 2.7 mp -139.54 133.09 37.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.166 0.507 . . . . 0.0 111.96 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.589 ' HB2' ' CG ' ' A' ' 93' ' ' TYR . 10.3 mt-10 -146.7 170.09 17.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.353 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.615 HG21 ' CD2' ' A' ' 27' ' ' TYR . 27.2 m -108.14 131.99 57.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.977 0.417 . . . . 0.0 111.546 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -91.49 -164.33 1.16 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.845 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.3 p90 -92.89 136.39 33.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.056 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.635 ' HA ' ' HB3' ' A' ' 90' ' ' ALA . 36.6 p30 -103.94 162.0 13.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.044 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.0 ttmt -58.92 -66.45 0.5 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.946 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 91.23 27.72 17.35 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.588 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -129.0 -54.35 1.21 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.836 0.35 . . . . 0.0 110.984 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.87 97.9 9.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.83 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.489 ' HB ' ' HA2' ' A' ' 86' ' ' GLY . 1.6 p -83.49 171.04 13.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.726 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -115.23 -51.79 2.7 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 44.3 tttm -110.83 -64.34 1.29 Allowed 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -179.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -133.77 2.45 3.43 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . 0.489 ' HA2' ' HB ' ' A' ' 82' ' ' THR . . . 128.15 51.01 0.14 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.307 -0.949 . . . . 0.0 112.601 -179.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 4.2 mtp85 -104.51 98.76 8.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.707 0.289 . . . . 0.0 110.991 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.457 ' O ' ' HB2' ' A' ' 34' ' ' PHE . . . -54.16 108.91 0.97 Allowed Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 178.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.736 HD13 HD13 ' A' ' 36' ' ' LEU . 0.2 OUTLIER -77.21 96.47 4.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.423 0.63 . . . . 0.0 112.63 -177.588 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.635 ' HB3' ' HA ' ' A' ' 77' ' ' ASP . . . -174.78 113.66 0.15 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.145 177.299 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.745 ' CD2' HG11 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -145.67 102.93 3.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.527 179.993 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.621 HD13 ' O ' ' A' ' 91' ' ' TYR . 32.1 mm -150.04 107.7 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.181 178.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.589 ' CG ' ' HB2' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -153.24 135.43 14.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.036 178.848 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -134.42 99.75 4.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.875 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.459 ' CA ' ' HB2' ' A' ' 71' ' ' LYS . 4.4 t0 57.89 41.55 24.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.822 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.493 -179.994 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.762 0.315 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.99 157.09 35.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.902 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -89.12 142.06 27.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.765 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.4 mmmt -83.62 107.97 16.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.017 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -140.33 133.74 15.08 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.698 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.425 ' HA ' ' HA ' ' A' ' 73' ' ' GLU . 98.4 Cg_endo -79.55 112.58 2.98 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.435 2.09 . . . . 0.0 112.636 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.647 ' HB1' ' O ' ' A' ' 26' ' ' MET . . . -166.07 104.6 0.66 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.026 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.818 HG23 HD22 ' A' ' 25' ' ' LEU . 0.3 OUTLIER -174.14 9.0 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.253 -0.43 . . . . 0.0 112.063 179.816 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.7 tp -98.67 85.08 3.26 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 120.691 -0.403 . . . . 0.0 111.346 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.608 HD11 ' N ' ' A' ' 26' ' ' MET . 32.5 mt -126.8 -68.43 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.91 178.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.9 tptt -130.99 122.76 27.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.297 178.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.879 ' HB2' ' CZ3' ' A' ' 66' ' ' TRP . . . -76.91 120.86 22.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.086 0.47 . . . . 0.0 112.028 -178.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.67 HD13 ' O ' ' A' ' 17' ' ' ALA . 25.0 mm -147.51 158.59 8.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.221 179.344 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.481 ' N ' HG22 ' A' ' 18' ' ' ILE . 0.8 OUTLIER -67.82 -176.16 0.63 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.534 179.836 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -66.84 70.22 0.18 Allowed Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.079 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.422 ' N ' ' O ' ' A' ' 19' ' ' ASP . 8.6 t70 -147.71 -51.98 0.19 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.912 0.386 . . . . 0.0 110.623 -179.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.455 ' HA ' ' O ' ' A' ' 34' ' ' PHE . 1.5 t -154.55 106.38 2.72 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.578 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.566 HG23 ' HB2' ' A' ' 34' ' ' PHE . 2.6 m -132.67 113.92 21.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.898 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.431 ' HG3' HG21 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -79.94 138.75 37.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.13 0.491 . . . . 0.0 112.011 -178.575 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.818 HD22 HG23 ' A' ' 13' ' ' THR . 0.1 OUTLIER -121.6 127.33 50.77 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.035 179.409 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.647 ' O ' ' HB1' ' A' ' 12' ' ' ALA . 0.4 OUTLIER -72.83 99.59 2.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.93 0.395 . . . . 0.0 110.886 -179.753 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -117.38 114.4 23.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.806 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 59.91 28.15 17.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.812 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 82.66 18.98 64.67 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.72 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.34 128.07 21.03 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.656 0.228 . . . . 0.0 110.952 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -74.14 126.93 10.87 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.444 2.096 . . . . 0.0 112.227 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 18.5 mmt -119.17 110.73 17.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.167 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.4 HG23 ' OG1' ' A' ' 22' ' ' THR . 14.3 m -70.98 157.13 38.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.334 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.814 ' CE1' HD11 ' A' ' 25' ' ' LEU . 1.9 m-85 -120.33 158.97 25.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.581 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -116.57 148.31 41.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.979 0.418 . . . . 0.0 111.082 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.762 HD23 ' O ' ' A' ' 37' ' ' LEU . 6.2 tt -48.71 119.46 3.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.487 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.762 ' O ' HD23 ' A' ' 36' ' ' LEU . 1.9 pp -49.06 165.23 0.06 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.912 179.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.464 ' O ' ' O ' ' A' ' 37' ' ' LEU . 23.0 tp . . . . . 0 N--CA 1.47 0.525 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -179.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.835 0.35 . . . . 0.0 111.38 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -88.87 -24.1 22.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.042 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -76.16 -28.85 57.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.253 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -56.88 -48.01 79.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.939 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.577 ' HB ' HD11 ' A' ' 92' ' ' ILE . 1.3 t -64.63 -15.48 61.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.383 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.5 tttp -89.14 -66.47 0.92 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.414 ' O ' ' N ' ' A' ' 68' ' ' ASN . 8.8 mttt -88.79 -64.34 1.16 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.978 0.418 . . . . 0.0 111.998 -178.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.416 ' O ' ' HB3' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -51.91 -21.53 3.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.745 -179.302 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . 0.879 ' CZ3' ' HB2' ' A' ' 17' ' ' ALA . 22.9 t90 -99.2 -37.34 9.33 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -179.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -94.11 -49.02 5.95 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -178.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.414 ' N ' ' O ' ' A' ' 64' ' ' LYS . 91.3 m-20 -79.72 -28.37 40.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.663 0.268 . . . . 0.0 111.565 -179.171 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 65' ' ' MET . . . -108.15 151.05 26.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.747 0.308 . . . . 0.0 111.092 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.2 mmtt -96.35 96.01 8.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.27 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.714 ' HB2' ' N ' ' A' ' 95' ' ' ASP . 0.0 OUTLIER -166.14 100.52 0.63 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.648 179.577 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.693 HD13 ' N ' ' A' ' 72' ' ' ILE . 0.0 OUTLIER -139.23 105.27 2.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.471 -179.659 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.425 ' HA ' ' HA ' ' A' ' 11' ' ' PRO . 2.6 mt-10 -128.73 169.7 14.19 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.249 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.527 HG22 HD13 ' A' ' 25' ' ' LEU . 21.1 t -115.18 147.4 18.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.852 179.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.42 ' HB2' ' CE2' ' A' ' 93' ' ' TYR . 4.8 tt0 -110.78 -69.95 0.84 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.696 0.284 . . . . 0.0 111.613 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -110.04 118.16 35.67 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.896 0.379 . . . . 0.0 111.371 -179.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -104.2 91.83 4.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.464 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -61.18 -83.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.043 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 91.86 -29.0 7.79 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.712 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -110.69 -38.35 5.18 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.785 0.326 . . . . 0.0 110.893 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.4 ttt-85 -75.99 63.39 1.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.81 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.414 ' CG2' ' HA2' ' A' ' 86' ' ' GLY . 10.4 p -87.7 151.09 23.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.712 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -114.97 -51.9 2.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.25 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.79 -64.03 1.32 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.866 0.365 . . . . 0.0 111.286 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -133.79 12.39 4.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.447 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . 0.414 ' HA2' ' CG2' ' A' ' 82' ' ' THR . . . 128.08 0.75 6.41 Favored Glycine 0 CA--C 1.519 0.342 0 C-N-CA 120.518 -0.849 . . . . 0.0 112.963 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -107.77 98.98 8.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.953 0.406 . . . . 0.0 110.978 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -117.32 -85.47 1.11 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.274 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.2 tp -102.28 101.01 11.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.721 0.296 . . . . 0.0 110.676 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.707 ' HB1' ' CD2' ' A' ' 34' ' ' PHE . . . -152.24 137.75 17.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.923 0.392 . . . . 0.0 111.506 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -142.15 122.23 13.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.635 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.577 HD11 ' HB ' ' A' ' 62' ' ' THR . 2.7 pt -89.49 149.9 3.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.832 0.349 . . . . 0.0 111.275 -179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.499 ' CD1' ' HA2' ' A' ' 96' ' ' GLY . 0.0 OUTLIER -137.77 168.09 20.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.081 179.466 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.615 ' HB1' ' HG3' ' A' ' 71' ' ' LYS . . . -94.08 99.73 11.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.715 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.714 ' N ' ' HB2' ' A' ' 71' ' ' LYS . 1.9 t0 76.6 21.0 1.34 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.125 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.499 ' HA2' ' CD1' ' A' ' 93' ' ' TYR . . . . . . . . 0 CA--C 1.517 0.184 0 C-N-CA 121.035 -0.602 . . . . 0.0 112.912 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.2 mtpt . . . . . 0 N--CA 1.458 -0.043 0 CA-C-O 120.92 0.39 . . . . 0.0 110.897 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.573 HD13 ' H ' ' A' ' 8' ' ' HIS . 0.2 OUTLIER -101.96 151.19 22.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.942 -179.96 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . 0.573 ' H ' HD13 ' A' ' 7' ' ' LEU . 13.7 t60 -120.56 88.92 3.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.675 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.72 158.18 29.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.01 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -104.76 158.6 31.67 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.714 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -78.87 157.31 27.42 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.426 2.084 . . . . 0.0 112.535 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.706 ' HB1' ' O ' ' A' ' 26' ' ' MET . . . -120.29 -90.25 0.58 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.318 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.662 HG23 ' O ' ' A' ' 12' ' ' ALA . 0.1 OUTLIER 175.67 164.24 0.33 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.89 0.376 . . . . 0.0 110.875 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.452 ' CB ' ' CZ2' ' A' ' 66' ' ' TRP . 1.7 pp -90.12 139.88 30.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.827 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.541 HD11 ' N ' ' A' ' 26' ' ' MET . 3.4 mt -125.08 -77.1 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.392 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.741 ' O ' HG13 ' A' ' 23' ' ' VAL . 18.9 mtpt -145.2 137.99 26.21 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.88 0.372 . . . . 0.0 110.961 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -126.35 106.3 9.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.984 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.691 HG23 ' H ' ' A' ' 19' ' ' ASP . 0.7 OUTLIER -51.28 -77.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.311 -179.858 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.691 ' H ' HG23 ' A' ' 18' ' ' ILE . 0.5 OUTLIER -118.16 -80.97 0.62 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.739 0.304 . . . . 0.0 110.841 179.896 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -174.71 33.5 0.1 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.528 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -122.08 -35.53 3.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.69 0.281 . . . . 0.0 111.039 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 t -147.03 139.58 24.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.808 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.741 HG13 ' O ' ' A' ' 16' ' ' LYS . 29.4 t -142.79 129.58 18.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.277 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.438 ' HA ' ' O ' ' A' ' 32' ' ' MET . 0.0 OUTLIER -79.65 143.68 34.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.203 -179.76 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.676 HD11 ' OH ' ' A' ' 91' ' ' TYR . 0.4 OUTLIER -136.52 165.01 26.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.645 179.797 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.706 ' O ' ' HB1' ' A' ' 12' ' ' ALA . 23.3 mmt -84.98 99.85 11.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.858 0.361 . . . . 0.0 110.87 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -115.63 95.7 5.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.868 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.6 mmtm 58.32 30.18 19.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.956 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 91.33 -14.07 64.73 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.629 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -99.31 141.42 22.81 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 120.694 0.283 . . . . 0.0 110.871 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.54 134.71 15.59 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.514 2.142 . . . . 0.0 112.249 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.455 ' HB3' ' CE1' ' A' ' 34' ' ' PHE . 3.5 mmt -129.19 110.54 12.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.926 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.72 86.75 4.15 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.918 -179.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.505 ' HB2' ' CD1' ' A' ' 91' ' ' TYR . 0.5 OUTLIER -137.78 107.11 6.1 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.779 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 tpt180 -140.38 127.72 21.22 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.481 HD22 ' O ' ' A' ' 89' ' ' LEU . 6.9 tp -143.12 111.06 5.99 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.349 178.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.676 HD11 ' HB1' ' A' ' 58' ' ' ALA . 0.6 OUTLIER -143.99 149.69 37.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.076 0.465 . . . . 0.0 111.603 -179.59 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.36 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.676 ' HB1' HD11 ' A' ' 37' ' ' LEU . . . . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.879 0.371 . . . . 0.0 111.102 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.7 t -60.08 -31.36 69.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.884 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -85.81 -29.98 23.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.199 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -60.25 -47.18 87.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.915 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.404 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 14.8 p -58.09 -50.08 74.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.82 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -21.63 9.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.107 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.3 tttm -88.44 -59.37 2.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.833 0.349 . . . . 0.0 110.961 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.8 mtt -90.27 -56.35 3.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.489 -179.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . 0.452 ' CZ2' ' CB ' ' A' ' 14' ' ' LEU . 28.4 t90 -53.94 -24.75 17.49 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.71 0.263 . . . . 0.0 111.71 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.32 -48.32 6.21 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.567 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.93 -28.2 39.75 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.53 ' HB3' ' HD3' ' A' ' 71' ' ' LYS . . . -105.02 151.23 24.21 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.785 0.326 . . . . 0.0 110.814 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.1 mmtt -95.37 92.95 6.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.878 -179.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.593 ' HB2' ' O ' ' A' ' 93' ' ' TYR . 0.0 OUTLIER -142.77 96.97 3.02 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.845 178.692 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.666 ' O ' HG23 ' A' ' 72' ' ' ILE . 0.5 OUTLIER -141.58 103.07 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.076 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.571 ' CB ' ' HB2' ' A' ' 93' ' ' TYR . 0.0 OUTLIER -166.81 178.65 5.75 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.664 -0.414 . . . . 0.0 111.263 177.862 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 90' ' ' ALA . 11.7 p -123.45 153.02 28.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.889 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -99.52 -118.38 0.15 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.588 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 54.8 p90 -107.07 134.15 50.63 Favored 'General case' 0 N--CA 1.457 -0.085 0 CA-C-O 120.798 0.332 . . . . 0.0 111.039 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.7 p-10 -78.7 117.95 20.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.942 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.25 -34.0 19.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.996 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 57.64 28.78 60.37 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.492 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -91.97 -64.05 1.16 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.718 0.294 . . . . 0.0 110.9 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -54.81 42.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.826 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.425 HG23 ' O ' ' A' ' 82' ' ' THR . 11.9 t -70.72 120.86 16.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.622 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -115.38 -51.27 2.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.971 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.7 pttm -101.41 -29.34 12.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.898 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.14 -35.65 76.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.54 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 67.7 24.19 74.04 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.684 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.427 ' HA ' ' CE2' ' A' ' 34' ' ' PHE . 0.6 OUTLIER -121.32 97.95 5.75 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.26 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -61.71 115.88 8.57 Favored Glycine 0 N--CA 1.452 -0.296 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 178.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.481 ' O ' HD22 ' A' ' 36' ' ' LEU . 1.5 mt -77.25 97.3 4.79 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.151 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.487 ' O ' HG23 ' A' ' 74' ' ' VAL . . . -174.17 114.24 0.19 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.116 177.722 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.676 ' OH ' HD11 ' A' ' 25' ' ' LEU . 0.3 OUTLIER -145.21 94.35 2.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.476 179.156 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 6.6 pt -150.17 108.86 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 C-N-CA 120.409 -0.516 . . . . 0.0 111.953 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.593 ' O ' ' HB2' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -151.65 168.78 23.91 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.387 179.294 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -122.07 106.48 11.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.833 0.349 . . . . 0.0 111.233 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.4 t0 52.07 26.21 3.66 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.835 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.268 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.57 -179.746 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.7 mttt . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.84 0.352 . . . . 0.0 110.858 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.408 HD13 ' C ' ' A' ' 75' ' ' GLU . 1.7 pp -69.96 156.9 38.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.146 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 12.9 t60 -90.49 159.1 16.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.704 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.52 120.41 42.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.915 0.388 . . . . 0.0 111.356 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.826 ' O ' HG23 ' A' ' 74' ' ' VAL . 12.5 mt-10 -137.83 129.02 15.98 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.336 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.757 ' HA ' ' HA ' ' A' ' 73' ' ' GLU . 87.7 Cg_endo -82.76 158.84 16.24 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.42 2.08 . . . . 0.0 112.939 -179.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.933 ' HB2' HD12 ' A' ' 25' ' ' LEU . . . -115.84 -129.87 0.3 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.56 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.645 HG23 ' O ' ' A' ' 12' ' ' ALA . 0.1 OUTLIER 175.99 -86.74 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.218 0 O-C-N 122.269 -0.27 . . . . 0.0 111.698 179.784 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.37 112.39 23.97 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.852 0.358 . . . . 0.0 111.234 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.807 HD11 HG21 ' A' ' 72' ' ' ILE . 2.6 mp -125.47 160.21 31.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.241 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.637 ' O ' HG12 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -115.19 122.8 47.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.374 179.439 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.405 ' HA ' HG12 ' A' ' 23' ' ' VAL . . . -112.29 123.61 50.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.447 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.636 HG23 ' H ' ' A' ' 19' ' ' ASP . 0.5 OUTLIER -117.87 -89.43 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.812 179.755 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.636 ' H ' HG23 ' A' ' 18' ' ' ILE . 1.0 OUTLIER -118.32 28.84 8.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.716 0.294 . . . . 0.0 110.977 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.551 ' HA3' HD23 ' A' ' 36' ' ' LEU . . . 61.32 57.42 18.34 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.233 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -147.19 -44.26 0.17 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.805 0.336 . . . . 0.0 110.795 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 54.6 p -132.51 106.87 8.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.182 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.637 HG12 ' O ' ' A' ' 16' ' ' LYS . 27.5 m -128.76 113.71 30.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.52 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.537 ' HB3' HG23 ' A' ' 33' ' ' THR . 12.6 ptmt -90.35 105.54 17.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.681 -179.257 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.933 HD12 ' HB2' ' A' ' 12' ' ' ALA . 1.7 pt? -108.1 165.05 11.77 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.347 179.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 2.7 ttm -77.37 99.85 5.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.857 0.361 . . . . 0.0 111.047 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.407 ' CE2' HG21 ' A' ' 74' ' ' VAL . 36.6 t80 -115.0 100.33 8.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.744 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 61.16 31.04 19.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.896 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.39 24.28 66.04 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.549 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -142.1 120.89 7.74 Favored Pre-proline 0 C--N 1.33 -0.257 0 O-C-N 122.769 -0.254 . . . . 0.0 110.981 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -59.72 132.41 45.3 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.353 2.035 . . . . 0.0 112.002 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 11.7 mtp -134.49 118.06 16.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.978 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.537 HG23 ' HB3' ' A' ' 24' ' ' LYS . 0.8 OUTLIER -95.59 127.21 41.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.102 -179.906 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.59 ' HE1' HD22 ' A' ' 25' ' ' LEU . 35.2 p90 -141.03 158.18 44.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.985 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -92.74 148.14 22.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.774 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.551 HD23 ' HA3' ' A' ' 20' ' ' GLY . 4.7 pp -48.98 153.95 0.81 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.297 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.765 ' HB3' ' HB3' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -66.96 155.05 39.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.093 -179.878 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.447 HD23 ' H ' ' A' ' 38' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.818 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.088 0 CA-C-O 120.735 0.303 . . . . 0.0 111.412 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 94.8 p -92.93 -16.04 25.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.538 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -83.84 -61.76 1.74 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.716 0.293 . . . . 0.0 111.451 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -54.78 -53.87 49.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.259 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.522 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 36.9 p -59.7 -21.05 60.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.233 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.403 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 11.5 tttt -89.11 -19.48 25.49 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.334 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp -88.59 -64.18 1.18 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.857 -179.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -89.14 -54.31 4.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.685 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . 0.522 ' HB3' ' O ' ' A' ' 62' ' ' THR . 37.8 t90 -58.75 -18.55 32.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.713 -179.281 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.403 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -90.81 -44.6 9.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.826 0.346 . . . . 0.0 111.192 -179.935 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -79.99 -28.04 39.56 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.184 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -108.04 151.21 26.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.86 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.2 ptpt -100.83 92.6 5.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.407 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.416 ' HG3' ' HA ' ' A' ' 94' ' ' ALA . 0.0 OUTLIER -138.26 98.03 3.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.052 179.423 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.807 HG21 HD11 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -139.86 119.88 13.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.771 0.319 . . . . 0.0 111.596 -179.545 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.757 ' HA ' ' HA ' ' A' ' 11' ' ' PRO . 10.4 mt-10 -149.25 172.11 15.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.479 179.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.826 HG23 ' O ' ' A' ' 10' ' ' GLU . 34.9 t -100.85 141.57 17.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.4 -179.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.408 ' C ' HD13 ' A' ' 7' ' ' LEU . 0.9 OUTLIER -135.14 -2.86 2.5 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -179.744 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.467 ' CD1' ' HB3' ' A' ' 91' ' ' TYR . 0.0 OUTLIER -92.68 164.32 13.43 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.884 0.373 . . . . 0.0 111.573 -179.634 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.406 ' CB ' ' HB3' ' A' ' 7' ' ' LEU . 3.1 t70 -100.85 139.19 36.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.911 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.0 pttp -68.77 108.44 3.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.954 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 88.08 41.11 6.35 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.481 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.12 -63.69 1.36 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.785 0.326 . . . . 0.0 110.816 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -162.12 94.82 0.93 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.007 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.449 ' HB ' ' HA2' ' A' ' 86' ' ' GLY . 7.6 p -74.37 154.31 38.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.769 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -115.23 -51.8 2.7 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.293 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.6 tptt -110.74 -64.0 1.33 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.788 0.328 . . . . 0.0 111.612 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.415 ' O ' ' CG ' ' A' ' 85' ' ' TYR . 81.9 t80 -133.9 11.15 3.96 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.623 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . 0.449 ' HA2' ' HB ' ' A' ' 82' ' ' THR . . . 128.09 -15.33 6.18 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.573 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -90.3 98.76 11.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.781 0.324 . . . . 0.0 110.929 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -147.11 -44.54 0.03 OUTLIER Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.438 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.41 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 4.3 mm? -81.5 148.36 29.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.897 0.38 . . . . 0.0 110.904 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.765 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . . . -102.67 142.56 33.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.206 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.718 ' HB2' HG13 ' A' ' 74' ' ' VAL . 1.8 p90 -141.04 88.01 2.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.012 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -150.2 141.2 16.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.081 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.442 ' CD1' ' HG3' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -123.36 117.99 26.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.619 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.416 ' HA ' ' HG3' ' A' ' 71' ' ' LYS . . . -111.43 91.87 3.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.051 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 58.2 23.81 10.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.065 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.356 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.551 -179.974 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 tppm? . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.813 0.34 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.833 HD13 ' N ' ' A' ' 8' ' ' HIS . 0.7 OUTLIER -96.2 146.62 24.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.92 -179.883 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . 0.833 ' N ' HD13 ' A' ' 7' ' ' LEU . 2.1 m-70 -114.03 109.77 18.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.912 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.787 ' CB ' HG23 ' A' ' 74' ' ' VAL . 1.0 OUTLIER -122.04 159.09 27.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.154 -179.852 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -104.09 164.27 15.66 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.627 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.447 ' CA ' ' HG3' ' A' ' 73' ' ' GLU . 91.0 Cg_endo -78.48 150.07 24.7 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.596 2.197 . . . . 0.0 112.692 -179.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.726 ' HB1' ' O ' ' A' ' 26' ' ' MET . . . -121.34 -81.86 0.64 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.194 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.67 HG23 ' O ' ' A' ' 12' ' ' ALA . 0.1 OUTLIER 171.36 131.25 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.725 0.298 . . . . 0.0 111.001 -179.984 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.742 HD13 ' N ' ' A' ' 15' ' ' ILE . 0.3 OUTLIER -98.19 130.29 44.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.994 179.716 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.742 ' N ' HD13 ' A' ' 14' ' ' LEU . 0.8 OUTLIER -84.46 -51.52 13.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.231 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.421 ' H ' HG13 ' A' ' 15' ' ' ILE . 14.2 tttm -164.46 151.26 11.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.518 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.687 ' HA ' HG12 ' A' ' 23' ' ' VAL . . . -125.43 148.05 48.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.406 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.9 pt -123.82 -167.0 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.914 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -71.19 62.7 0.33 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.796 0.332 . . . . 0.0 111.431 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.427 ' HA3' ' CD2' ' A' ' 36' ' ' LEU . . . 44.33 77.22 0.1 OUTLIER Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.989 -0.625 . . . . 0.0 113.095 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -147.64 -46.26 0.17 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.98 0.419 . . . . 0.0 110.796 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -167.99 106.93 0.52 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.873 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.776 HG22 ' O ' ' A' ' 34' ' ' PHE . 32.6 m -121.35 113.85 41.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.672 179.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.4 ' O ' HG13 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -87.66 147.4 25.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.358 -179.548 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.768 HD21 ' CD2' ' A' ' 34' ' ' PHE . 0.1 OUTLIER -137.99 137.21 37.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.176 179.622 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.726 ' O ' ' HB1' ' A' ' 12' ' ' ALA . 3.1 tpt -72.75 99.43 2.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.923 0.392 . . . . 0.0 110.863 -179.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -118.78 116.22 26.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.702 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 25.4 mmtm 58.86 28.09 17.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.89 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.12 25.5 66.28 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.553 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -142.07 113.07 6.28 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 120.453 0.168 . . . . 0.0 110.901 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.83 141.0 95.9 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.477 2.118 . . . . 0.0 112.271 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.439 ' HB3' ' CZ ' ' A' ' 34' ' ' PHE . 0.6 OUTLIER -142.2 110.92 6.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.979 -179.848 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.422 ' O ' ' CD1' ' A' ' 34' ' ' PHE . 1.4 t -78.28 139.9 38.86 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.196 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.776 ' O ' HG22 ' A' ' 23' ' ' VAL . 26.0 m-85 -141.39 138.51 33.04 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.194 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -101.11 148.07 25.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.641 179.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.447 ' O ' HD12 ' A' ' 36' ' ' LEU . 0.3 OUTLIER -56.57 169.3 0.48 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.34 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.685 ' H ' HD13 ' A' ' 37' ' ' LEU . 0.0 OUTLIER -95.73 163.06 13.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.932 179.832 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.772 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.805 0.336 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 t -71.59 -24.12 61.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.063 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -55.5 -23.24 24.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.371 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -53.38 -52.06 60.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.085 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.405 ' O ' ' N ' ' A' ' 66' ' ' TRP . 1.3 p -60.98 -47.86 84.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.966 0.412 . . . . 0.0 110.914 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.2 mtmt -55.7 -20.03 12.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.358 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.4 tptt -84.98 -59.8 2.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.722 0.296 . . . . 0.0 111.37 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 14.0 mtt -90.01 -49.9 6.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.313 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . 0.862 ' CE2' HG22 ' A' ' 72' ' ' ILE . 10.0 t-105 -54.79 -34.72 63.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.303 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -94.49 -52.13 4.46 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -79.79 -28.38 40.3 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.353 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.637 ' HB3' ' HD3' ' A' ' 71' ' ' LYS . . . -107.22 151.16 25.8 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.839 0.352 . . . . 0.0 111.224 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.4 tttt -89.69 92.99 9.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.568 -179.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.637 ' HD3' ' HB3' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -166.22 98.33 0.61 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.556 179.096 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.862 HG22 ' CE2' ' A' ' 66' ' ' TRP . 4.8 pt -139.9 128.79 27.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.0 0.428 . . . . 0.0 111.828 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.447 ' HG3' ' CA ' ' A' ' 11' ' ' PRO . 0.2 OUTLIER -162.42 171.02 17.81 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.032 179.605 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.787 HG23 ' CB ' ' A' ' 9' ' ' LYS . 0.4 OUTLIER -111.28 152.99 13.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.809 179.699 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -93.51 -79.66 0.4 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.521 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.42 ' O ' ' CE1' ' A' ' 91' ' ' TYR . 7.0 p90 -129.73 141.44 50.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.807 0.337 . . . . 0.0 111.324 -179.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -104.05 110.38 22.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.748 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.421 ' HB2' HD21 ' A' ' 89' ' ' LEU . 1.6 tttt -58.83 -35.23 72.57 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.903 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 106.16 28.04 5.38 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.431 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -106.97 161.7 14.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.79 0.329 . . . . 0.0 110.839 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.77 45.15 2.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.883 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 1.8 p -95.88 126.49 41.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.945 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -115.12 -50.85 2.74 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.948 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -104.64 -21.67 13.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.139 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -55.45 -30.64 60.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.235 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 125.19 51.35 0.18 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.535 -0.841 . . . . 0.0 112.554 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.584 ' NE ' HD12 ' A' ' 89' ' ' LEU . 1.7 ttt85 -58.75 112.85 1.78 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.883 0.373 . . . . 0.0 110.959 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -105.32 22.07 33.72 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.779 -0.725 . . . . 0.0 112.561 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.584 HD12 ' NE ' ' A' ' 87' ' ' ARG . 38.2 mt -78.06 148.02 34.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.715 0.293 . . . . 0.0 110.695 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -105.95 134.29 49.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.033 0.444 . . . . 0.0 111.502 -179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.756 ' HB3' HG12 ' A' ' 74' ' ' VAL . 96.9 m-85 -142.12 90.22 2.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.456 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.623 HD13 ' O ' ' A' ' 91' ' ' TYR . 25.3 mm -133.82 116.89 24.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.983 0.421 . . . . 0.0 111.818 -179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.44 ' HB3' ' HB3' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -151.13 117.78 5.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.326 179.219 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.512 ' HB1' ' HG3' ' A' ' 71' ' ' LYS . . . -94.38 113.36 25.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.679 -179.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.512 ' N ' ' HB2' ' A' ' 71' ' ' LYS . 16.3 t70 49.97 25.91 1.82 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.985 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.41 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.237 -179.762 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.856 0.36 . . . . 0.0 110.811 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.97 141.17 34.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.865 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -93.63 159.07 15.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.846 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.4 mttp -75.86 107.9 8.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.021 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.771 ' O ' HG12 ' A' ' 74' ' ' VAL . 2.4 mt-10 -139.13 143.54 37.11 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.521 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.522 ' HA ' ' HA ' ' A' ' 73' ' ' GLU . 84.2 Cg_endo -83.75 164.37 13.98 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.476 2.117 . . . . 0.0 112.711 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.816 ' HB1' HD22 ' A' ' 25' ' ' LEU . . . -119.29 104.69 10.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.999 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 44.7 p -64.69 80.94 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.273 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.745 HD22 ' HB ' ' A' ' 62' ' ' THR . 3.2 tt -69.7 120.96 16.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.431 179.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 26.4 mt -125.27 -69.86 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.863 ' O ' HG13 ' A' ' 23' ' ' VAL . 3.7 pttt -121.68 145.95 47.5 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.925 0.393 . . . . 0.0 111.435 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.761 ' HB2' HG22 ' A' ' 23' ' ' VAL . . . -124.08 147.52 47.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.868 179.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.6 mm -96.81 -88.92 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.346 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -118.25 107.32 13.77 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.8 0.333 . . . . 0.0 111.045 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 98.67 -113.99 4.89 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.447 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -123.25 16.39 9.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.599 0.237 . . . . 0.0 111.159 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.6 t -74.85 106.78 6.55 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.893 0.378 . . . . 0.0 110.725 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.863 HG13 ' O ' ' A' ' 16' ' ' LYS . 16.8 t -128.77 134.67 63.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.966 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.523 ' CD ' HG23 ' A' ' 33' ' ' THR . 0.0 OUTLIER -79.73 97.86 6.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.707 -179.928 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.816 HD22 ' HB1' ' A' ' 12' ' ' ALA . 0.2 OUTLIER -99.38 142.53 30.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.867 -179.769 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.76 100.0 3.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.915 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -96.73 100.42 11.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.873 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.9 tttm 56.31 31.35 18.43 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.988 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 90.54 20.92 39.12 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.823 -0.704 . . . . 0.0 112.576 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.89 112.5 6.88 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.572 0.225 . . . . 0.0 110.778 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.2 129.49 21.8 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.351 2.034 . . . . 0.0 112.358 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 34' ' ' PHE . 33.6 mmm -145.04 118.7 9.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.933 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.523 HG23 ' CD ' ' A' ' 24' ' ' LYS . 0.8 OUTLIER -70.38 135.34 48.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.077 -179.966 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.726 ' HB3' ' HB3' ' A' ' 90' ' ' ALA . 27.0 m-85 -140.69 152.75 45.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.907 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtt-85 -117.3 148.0 42.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.972 0.415 . . . . 0.0 111.081 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.653 HD12 ' HB3' ' A' ' 91' ' ' TYR . 35.0 tp -78.06 138.39 38.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.786 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.71 HD23 ' O ' ' A' ' 37' ' ' LEU . 8.5 tt -82.83 94.34 7.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.804 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.421 HD23 ' HG ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.909 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.807 0.337 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.88 ' O ' HG22 ' A' ' 62' ' ' THR . 20.7 p -69.52 -24.54 63.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.238 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -54.72 -23.51 18.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.613 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -55.1 -31.11 60.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.815 0.34 . . . . 0.0 111.198 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.88 HG22 ' O ' ' A' ' 59' ' ' SER . 13.0 t -79.07 -17.48 55.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.279 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 67' ' ' GLU . 0.5 OUTLIER -89.41 -57.28 2.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.847 0.356 . . . . 0.0 111.441 -179.73 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.0 mtmp? -88.65 -59.18 2.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.205 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.847 ' HA ' ' HB3' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -55.67 -20.36 13.86 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.664 -179.347 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . 0.447 ' CE2' ' CG ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -99.22 -33.71 10.65 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.359 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.413 ' HB2' ' O ' ' A' ' 63' ' ' LYS . 5.2 mt-10 -94.0 -56.32 2.91 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 -179.534 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -80.17 -28.87 38.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.892 0.377 . . . . 0.0 110.991 -179.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.847 ' HB3' ' HA ' ' A' ' 65' ' ' MET . . . -108.78 152.6 24.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.698 179.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.401 ' HG2' ' HB3' ' A' ' 95' ' ' ASP . 0.0 OUTLIER -52.48 163.74 0.4 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.46 -179.754 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.447 ' CG ' ' CE2' ' A' ' 66' ' ' TRP . 0.1 OUTLIER -84.9 162.06 19.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.108 0.48 . . . . 0.0 111.486 -178.622 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.959 HD13 HG22 ' A' ' 92' ' ' ILE . 1.1 pp -102.83 145.22 12.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.849 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.522 ' HA ' ' HA ' ' A' ' 11' ' ' PRO . 44.5 mt-10 -127.89 179.1 5.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.634 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.771 HG12 ' O ' ' A' ' 10' ' ' GLU . 10.6 p -112.34 140.97 29.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.907 0.384 . . . . 0.0 111.055 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -106.88 -66.89 0.98 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.02 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 35.8 p90 -143.0 129.35 19.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.947 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.53 157.84 15.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.993 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -49.56 77.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.811 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 64.0 32.28 83.65 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.591 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -101.57 9.39 41.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.614 0.245 . . . . 0.0 111.315 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 26.4 mtm180 54.57 95.43 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.714 0.292 . . . . 0.0 111.175 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 41.7 m -62.2 148.98 42.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.908 0.385 . . . . 0.0 110.664 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -115.29 -40.18 3.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.287 -179.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.41 -63.11 1.02 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.245 -179.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -127.36 -35.15 2.21 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.15 -179.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 109.56 49.8 0.73 Allowed Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.728 -0.749 . . . . 0.0 111.845 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.403 ' HB2' ' CZ ' ' A' ' 87' ' ' ARG . 2.5 mtm105 -131.92 101.77 5.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.782 0.325 . . . . 0.0 111.022 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -48.83 171.44 0.07 OUTLIER Glycine 0 CA--C 1.518 0.26 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.415 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.4 mp -111.19 112.66 24.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.84 0.352 . . . . 0.0 111.192 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.726 ' HB3' ' HB3' ' A' ' 34' ' ' PHE . . . -128.62 130.08 46.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.798 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.653 ' HB3' HD12 ' A' ' 36' ' ' LEU . 0.0 OUTLIER -98.85 149.82 22.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.066 -179.762 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.959 HG22 HD13 ' A' ' 72' ' ' ILE . 2.7 pp -79.88 160.12 4.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.056 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.589 ' O ' HG22 ' A' ' 72' ' ' ILE . 5.8 m-85 -140.85 168.23 20.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.947 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.84 112.52 24.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.996 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.401 ' HB3' ' HG2' ' A' ' 70' ' ' LYS . 3.9 p30 45.21 41.93 6.46 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.412 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.29 0 C-N-CA 120.657 -0.783 . . . . 0.0 112.673 179.955 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.6 tptt . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.826 0.346 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.601 HD11 ' HE2' ' A' ' 27' ' ' TYR . 0.5 OUTLIER -76.4 120.26 21.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.005 179.98 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . 0.414 ' CE1' ' OH ' ' A' ' 27' ' ' TYR . 12.8 p-80 -70.99 157.19 38.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.703 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.6 mmtp -94.98 112.65 24.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.423 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.0 113.75 32.67 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.246 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.43 ' HA ' ' O ' ' A' ' 72' ' ' ILE . 83.1 Cg_endo -86.65 109.31 0.85 Allowed 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.513 2.142 . . . . 0.0 113.223 -178.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -166.42 -78.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.556 179.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.636 HG22 ' HB2' ' A' ' 25' ' ' LEU . 30.1 p 41.88 28.74 0.1 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 179.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.459 ' O ' HD13 ' A' ' 15' ' ' ILE . 1.0 OUTLIER -98.16 85.55 3.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.857 0.36 . . . . 0.0 110.563 179.411 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.475 HG21 ' HG2' ' A' ' 24' ' ' LYS . 10.5 mm -126.29 -69.81 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.88 179.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -141.85 173.04 11.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.304 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -122.35 140.0 53.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.034 0.445 . . . . 0.0 111.554 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.857 HG22 HG12 ' A' ' 23' ' ' VAL . 7.8 tt -173.6 164.23 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.768 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.42 171.97 5.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.784 0.326 . . . . 0.0 110.872 -179.656 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -60.86 82.98 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.617 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -147.27 -49.66 0.18 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.083 0.468 . . . . 0.0 110.47 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 t -172.06 106.58 0.2 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.515 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.857 HG12 HG22 ' A' ' 18' ' ' ILE . 35.9 m -122.52 127.59 75.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.122 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.475 ' HG2' HG21 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -79.21 133.99 36.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.864 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.649 HD23 ' O ' ' A' ' 32' ' ' MET . 0.5 OUTLIER -126.29 148.08 49.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.632 179.975 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.74 101.81 3.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.054 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.601 ' HE2' HD11 ' A' ' 7' ' ' LEU . 3.0 t80 -119.81 120.53 36.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.745 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.3 pttt 49.09 28.11 1.98 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.341 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.65 10.36 85.91 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.82 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.429 ' HA ' ' HD3' ' A' ' 31' ' ' PRO . 1.7 mm-40 -121.97 142.46 36.44 Favored Pre-proline 0 CA--C 1.53 0.197 0 CA-C-N 116.726 0.263 . . . . 0.0 110.888 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 30' ' ' GLN . 35.0 Cg_exo -59.87 127.56 23.83 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.493 2.129 . . . . 0.0 112.264 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.649 ' O ' HD23 ' A' ' 25' ' ' LEU . 25.6 mmt -145.21 110.75 5.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.782 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' A' ' 23' ' ' VAL . 1.6 t -101.41 86.93 3.08 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.878 0.37 . . . . 0.0 111.829 -179.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.65 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -113.48 107.65 16.11 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.961 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.818 ' HA ' ' O ' ' A' ' 90' ' ' ALA . 16.5 tpt180 -143.88 95.01 2.66 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.202 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.927 HD22 HD23 ' A' ' 89' ' ' LEU . 0.1 OUTLIER -145.39 88.42 1.86 Allowed 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.386 178.551 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.655 HD23 ' HE ' ' A' ' 35' ' ' ARG . 3.2 pp -110.02 126.35 53.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.003 0.43 . . . . 0.0 110.754 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.641 -179.352 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.081 0 CA-C-O 120.862 0.363 . . . . 0.0 111.106 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.7 t -77.73 -16.02 58.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.406 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -50.89 -29.52 12.17 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.827 0.346 . . . . 0.0 111.5 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.52 ' HB3' HD11 ' A' ' 92' ' ' ILE . 4.7 m-85 -57.48 -34.82 69.43 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.867 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.539 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 29.3 p -91.17 -15.29 29.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.215 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.428 ' O ' ' HB2' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -89.69 -56.96 3.04 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -179.264 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.8 tmtt? -89.18 -64.57 1.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.496 ' HA ' ' HB3' ' A' ' 69' ' ' ALA . 0.5 OUTLIER -59.43 -20.47 55.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.464 -178.311 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' TRP . . . . . 0.539 ' HB3' ' O ' ' A' ' 62' ' ' THR . 23.9 t90 -99.39 -33.83 10.54 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -179.067 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.428 ' HB2' ' O ' ' A' ' 63' ' ' LYS . 9.7 mm-40 -94.12 -53.57 3.91 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 -179.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -79.75 -28.32 40.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.654 0.264 . . . . 0.0 111.578 -178.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.496 ' HB3' ' HA ' ' A' ' 65' ' ' MET . . . -108.23 151.29 26.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.813 0.339 . . . . 0.0 111.23 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.1 mtmp? -97.94 94.83 7.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.274 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.511 ' HG3' ' HB1' ' A' ' 94' ' ' ALA . 0.0 OUTLIER -164.45 98.95 0.81 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.502 179.567 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.467 HG22 ' CD1' ' A' ' 66' ' ' TRP . 0.0 OUTLIER -133.48 127.48 53.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.12 179.864 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -162.87 158.26 22.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.735 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.604 HG11 HD13 ' A' ' 25' ' ' LEU . 7.3 m -133.54 152.52 35.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.145 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -157.54 93.55 1.3 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.864 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.56 ' CD1' ' HB2' ' A' ' 90' ' ' ALA . 42.0 p90 -143.13 118.11 10.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.155 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -91.91 91.9 8.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.606 179.683 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.482 ' HE3' HD13 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -94.52 -68.83 0.78 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.126 -179.719 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 64.13 27.31 71.27 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.352 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -129.18 116.05 18.61 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.977 0.418 . . . . 0.0 110.8 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.36 102.04 0.16 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.916 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.54 HG21 ' H ' ' A' ' 87' ' ' ARG . 26.7 m -58.77 149.12 27.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.44 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -115.74 -48.78 2.75 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -178.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.33 -63.17 0.58 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.309 -0.405 . . . . 0.0 112.049 -178.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -133.31 -35.33 1.03 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.788 0.328 . . . . 0.0 111.25 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . 0.42 ' HA2' ' HB ' ' A' ' 82' ' ' THR . . . 120.55 34.61 0.92 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.816 -179.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.54 ' H ' HG21 ' A' ' 82' ' ' THR . 0.1 OUTLIER -138.89 120.38 15.02 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.104 0.478 . . . . 0.0 110.945 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -75.01 -140.16 0.7 Allowed Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 115.791 -0.64 . . . . 0.0 112.759 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.927 HD23 HD22 ' A' ' 36' ' ' LEU . 3.4 mp -128.46 116.01 19.05 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 122.109 0.163 . . . . 0.0 111.134 -179.409 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.818 ' O ' ' HA ' ' A' ' 35' ' ' ARG . . . -136.33 161.98 34.3 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 178.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.497 ' N ' ' CD1' ' A' ' 91' ' ' TYR . 0.0 OUTLIER -132.07 158.07 42.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.403 -178.874 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.52 HD11 ' HB3' ' A' ' 61' ' ' PHE . 2.4 pp -79.94 148.16 6.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.342 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -140.17 129.69 24.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.878 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.511 ' HB1' ' HG3' ' A' ' 71' ' ' LYS . . . -83.98 110.23 18.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.378 -179.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.501 ' N ' ' HB2' ' A' ' 71' ' ' LYS . 1.5 t70 60.72 20.22 10.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.685 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.518 -179.939 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.755 0.312 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.2 t -85.94 113.1 21.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.886 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.3 t -75.28 114.07 13.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.918 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.76 123.55 28.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.764 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.2 ttpp -72.32 107.09 4.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.026 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -109.0 121.3 44.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.669 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.519 HD21 ' H ' ' A' ' 77' ' ' ASP . 1.5 pp -87.8 120.34 29.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.115 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -81.39 88.8 6.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.515 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.548 ' HE2' HG21 ' A' ' 74' ' ' VAL . 1.8 tttt -88.11 159.45 18.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.409 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.16 165.39 13.69 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.202 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.497 ' HB3' ' CG ' ' A' ' 73' ' ' GLU . 93.2 Cg_endo -77.55 163.14 29.81 Favored 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.347 2.031 . . . . 0.0 112.289 -178.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.663 ' HB3' HD23 ' A' ' 25' ' ' LEU . . . -115.56 -165.38 1.03 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.13 0.491 . . . . 0.0 111.716 -179.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.5 p -116.36 -174.89 2.64 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.06 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.515 HD22 ' O ' ' A' ' 62' ' ' THR . 61.1 tp -98.34 113.86 25.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.814 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 22.4 mm -125.18 -43.88 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.914 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.909 ' O ' HG13 ' A' ' 23' ' ' VAL . 6.3 tttt -142.12 141.54 32.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.716 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -127.01 119.32 26.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.153 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.931 HD12 HG23 ' A' ' 22' ' ' THR . 23.7 mt -150.61 152.88 11.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.096 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -68.6 76.8 0.29 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.893 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 48.51 74.05 0.29 Allowed Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.529 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.412 ' HB2' HG21 ' A' ' 18' ' ' ILE . 71.9 m-20 -147.8 -48.7 0.17 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.129 0.49 . . . . 0.0 110.575 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.931 HG23 HD12 ' A' ' 18' ' ' ILE . 1.3 t -169.87 106.57 0.35 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.676 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.909 HG13 ' O ' ' A' ' 16' ' ' LYS . 41.5 t -127.24 113.42 32.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.526 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.38 127.47 32.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.264 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.663 HD23 ' HB3' ' A' ' 12' ' ' ALA . 7.1 mp -114.6 139.06 49.92 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.334 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.86 99.39 2.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.914 0.388 . . . . 0.0 110.793 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -116.36 115.39 25.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.751 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.3 ttmp? 63.84 25.23 13.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.013 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 93.88 -13.97 66.29 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.642 -0.789 . . . . 0.0 112.884 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -112.3 139.45 22.55 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.835 0.318 . . . . 0.0 111.011 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -79.21 139.02 14.61 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.684 2.256 . . . . 0.0 112.419 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.485 ' HB3' ' CZ ' ' A' ' 34' ' ' PHE . 3.1 mmt -139.34 128.22 23.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.935 0.397 . . . . 0.0 111.029 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.485 HG21 ' OG1' ' A' ' 22' ' ' THR . 86.7 m -79.31 127.8 32.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.905 -179.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.989 ' CB ' ' HB3' ' A' ' 90' ' ' ALA . 38.0 m-85 -141.33 130.92 23.98 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.45 179.083 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -143.33 96.26 2.89 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.754 HD21 ' OD2' ' A' ' 83' ' ' ASP . 0.2 OUTLIER -144.34 87.29 1.87 Allowed 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.364 177.497 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.617 ' O ' HD23 ' A' ' 38' ' ' LEU . 0.6 OUTLIER -145.71 103.9 3.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.931 0.396 . . . . 0.0 111.267 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.617 HD23 ' O ' ' A' ' 37' ' ' LEU . 55.9 mt -149.88 113.03 4.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.006 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 19.3 t -142.0 126.5 16.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.998 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -135.24 100.27 4.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.114 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 35.9 m -157.12 101.08 1.93 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.841 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.407 ' HG2' ' HA ' ' A' ' 47' ' ' PRO . 56.2 Cg_endo -70.36 163.05 40.14 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.437 2.091 . . . . 0.0 112.507 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -73.33 -16.24 61.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.382 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -60.84 151.16 30.65 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.677 0.275 . . . . 0.0 110.772 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 4.1 mtmt -45.36 -58.36 3.38 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.232 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -87.31 106.99 12.8 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.407 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.407 ' HA ' ' HG2' ' A' ' 42' ' ' PRO . 38.0 Cg_endo -66.73 105.45 0.94 Allowed 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.241 1.961 . . . . 0.0 112.333 -179.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.45 96.82 4.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.691 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 16.1 mtmm 55.22 98.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.99 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.41 -145.88 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.596 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 18.7 m -71.13 144.43 13.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.782 0.325 . . . . 0.0 111.191 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.99 -177.94 3.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.835 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.707 ' NZ ' HG13 ' A' ' 104' ' ' VAL . 0.0 OUTLIER -58.93 95.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.846 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -67.73 -34.04 76.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.986 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 172.08 166.33 30.56 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.55 -0.834 . . . . 0.0 112.843 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.29 -2.42 12.61 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.826 2.35 . . . . 0.0 112.806 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -44.0 -28.03 0.43 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.843 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.428 ' HA ' ' CD2' ' A' ' 61' ' ' PHE . . . -45.61 -49.09 14.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.84 0.352 . . . . 0.0 111.412 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.2 p -54.0 -22.14 9.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.545 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -86.02 -31.2 22.13 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.861 0.362 . . . . 0.0 110.768 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.491 ' CA ' ' HB2' ' A' ' 65' ' ' MET . 19.0 m-30 -55.56 -30.59 61.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.743 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.583 ' HA ' ' HB2' ' A' ' 66' ' ' TRP . 0.0 OUTLIER -63.68 -14.79 55.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.549 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.7 mtpt -90.94 -68.36 0.8 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.139 0.495 . . . . 0.0 111.418 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.1 mttt -87.96 -51.49 5.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.084 -179.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.603 ' O ' ' HB3' ' A' ' 69' ' ' ALA . 2.1 mmt -63.63 -13.98 47.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.568 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . 0.583 ' HB2' ' HA ' ' A' ' 62' ' ' THR . 18.8 t90 -83.56 -34.96 25.09 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 121.392 0.615 . . . . 0.0 109.668 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -94.34 -22.99 17.99 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.118 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -114.1 -28.15 7.42 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.653 ' HB1' ' CB ' ' A' ' 95' ' ' ASP . . . -108.22 154.66 21.44 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.39 -178.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.505 ' O ' ' N ' ' A' ' 96' ' ' GLY . 0.0 OUTLIER -51.24 100.45 0.03 OUTLIER 'General case' 0 C--O 1.225 -0.188 0 CA-C-O 122.059 0.933 . . . . 0.0 108.676 -179.828 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.575 ' HB3' ' HA ' ' A' ' 66' ' ' TRP . 0.0 OUTLIER -84.97 174.41 9.79 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.312 -1.313 . . . . 0.0 114.019 -176.377 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.826 HG21 HG23 ' A' ' 92' ' ' ILE . 23.1 pt -63.96 141.05 18.69 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.21 0 CA-C-O 122.278 1.037 . . . . 0.0 113.757 -175.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.497 ' CG ' ' HB3' ' A' ' 11' ' ' PRO . 41.2 mt-10 -158.78 157.57 31.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 113.371 -1.741 . . . . 0.0 107.927 179.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.548 HG21 ' HE2' ' A' ' 9' ' ' LYS . 1.7 p -100.85 145.12 11.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.359 -0.536 . . . . 0.0 111.073 -179.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.412 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -125.79 -69.25 0.79 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.534 -179.197 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.412 ' CD1' ' HB3' ' A' ' 75' ' ' GLU . 12.6 p90 -138.67 156.4 47.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.947 0.403 . . . . 0.0 111.236 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.519 ' H ' HD21 ' A' ' 7' ' ' LEU . 6.3 m-20 -104.03 158.47 16.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.823 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.9 tptt -87.42 -40.72 14.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.044 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 106.02 26.46 6.04 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.573 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -118.56 -40.47 2.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.907 0.384 . . . . 0.0 110.701 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.749 ' HA ' HD22 ' A' ' 89' ' ' LEU . 0.0 OUTLIER 80.04 -54.76 0.38 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.191 179.848 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.551 HG22 ' HG3' ' A' ' 81' ' ' ARG . 1.3 t -110.04 120.61 43.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.651 0.262 . . . . 0.0 111.078 179.555 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.754 ' OD2' HD21 ' A' ' 36' ' ' LEU . 0.2 OUTLIER -115.54 -51.58 2.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.261 179.893 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.34 -63.22 1.41 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.195 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -103.51 -35.2 8.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.898 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.483 ' HA2' ' CB ' ' A' ' 82' ' ' THR . . . 108.61 51.09 0.72 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.005 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 61.5 mtt-85 -130.43 97.85 4.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.909 0.385 . . . . 0.0 111.208 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.425 ' HA3' ' O ' ' A' ' 33' ' ' THR . . . 53.01 168.38 0.02 OUTLIER Glycine 0 C--N 1.331 0.255 0 CA-C-N 115.919 -0.582 . . . . 0.0 113.136 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.749 HD22 ' HA ' ' A' ' 81' ' ' ARG . 1.0 OUTLIER -128.74 97.93 4.83 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.542 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.989 ' HB3' ' CB ' ' A' ' 34' ' ' PHE . . . -165.46 148.0 7.75 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.064 0.459 . . . . 0.0 111.659 178.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.662 ' N ' ' CD1' ' A' ' 91' ' ' TYR . 0.1 OUTLIER -92.5 136.96 32.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.906 -177.665 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.848 HD11 ' O ' ' A' ' 34' ' ' PHE . 2.5 mp -89.52 109.62 20.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.318 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.626 ' N ' HG22 ' A' ' 72' ' ' ILE . 3.5 m-85 -88.41 117.49 27.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.86 0.362 . . . . 0.0 110.613 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -113.47 121.26 43.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.914 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.653 ' CB ' ' HB1' ' A' ' 69' ' ' ALA . 4.6 p-10 44.78 44.56 7.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.078 0.466 . . . . 0.0 110.838 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 70' ' ' LYS . . . 52.32 18.36 4.9 Favored Glycine 0 CA--C 1.52 0.365 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.931 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -137.55 120.88 16.96 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.658 0.266 . . . . 0.0 110.759 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 2.7 mpp? -65.75 121.59 15.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.659 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 10.9 p -57.4 -34.62 46.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.094 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 61.32 103.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.982 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -135.15 118.8 17.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.816 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -166.24 135.64 3.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.236 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 32.4 mt 59.69 165.32 0.06 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.991 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.707 HG13 ' NZ ' ' A' ' 53' ' ' LYS . 21.5 t -127.81 99.53 5.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.021 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 66.77 -73.97 0.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.752 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -147.81 -47.15 0.16 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.831 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -154.5 67.72 0.31 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.519 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 14.2 tp 61.71 45.16 8.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.81 0.338 . . . . 0.0 110.791 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 60.94 85.95 0.11 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.146 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.232 -0.889 . . . . 0.0 110.91 -179.992 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.831 0.348 . . . . 0.0 111.0 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 68.1 p -101.86 125.83 48.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.861 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 44.8 t -69.28 128.6 37.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.857 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -106.5 148.38 28.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.934 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.56 138.61 48.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.903 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.1 115.11 24.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.014 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.95 HD21 ' CG ' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -84.06 151.08 25.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.72 -179.997 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.718 ' H ' HD13 ' A' ' 7' ' ' LEU . 7.3 m80 -117.81 136.56 53.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.934 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -116.94 116.25 27.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.953 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.431 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 0.4 OUTLIER -155.14 145.48 15.95 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.159 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.549 ' HB3' HG21 ' A' ' 72' ' ' ILE . 73.7 Cg_endo -78.44 141.1 17.62 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.14 1.893 . . . . 0.0 112.526 -179.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.839 ' O ' HD11 ' A' ' 72' ' ' ILE . . . -115.32 -165.42 1.03 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.031 -179.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.442 HG22 ' H ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -120.03 -168.86 1.68 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.976 0.417 . . . . 0.0 111.276 -179.501 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.442 ' H ' HG22 ' A' ' 13' ' ' THR . 0.9 OUTLIER -53.86 157.27 2.45 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.417 -179.746 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.462 ' CG2' ' HB3' ' A' ' 25' ' ' LEU . 1.2 pp -112.03 -179.12 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.089 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.76 172.97 6.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.837 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.761 ' O ' HD13 ' A' ' 18' ' ' ILE . . . -106.47 126.81 52.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.116 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.761 HD13 ' O ' ' A' ' 17' ' ' ALA . 19.7 mm -141.41 158.17 21.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.214 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.471 ' N ' HG22 ' A' ' 18' ' ' ILE . 12.9 p-10 -72.96 66.42 0.79 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.81 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 160.88 -130.55 2.39 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.361 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.525 ' O ' HG13 ' A' ' 23' ' ' VAL . 52.0 m-20 -113.09 -15.26 12.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.696 0.284 . . . . 0.0 110.887 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.548 ' OG1' HG21 ' A' ' 18' ' ' ILE . 31.1 p -54.6 109.08 0.45 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.97 0.414 . . . . 0.0 111.424 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.617 ' O ' HD23 ' A' ' 25' ' ' LEU . 35.3 m -122.73 118.89 56.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.619 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.86 106.49 16.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.492 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.663 HD11 ' CD ' ' A' ' 75' ' ' GLU . 0.3 OUTLIER -118.76 164.95 14.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.593 179.513 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 2.4 ttp -79.95 99.8 7.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.567 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.425 ' CD1' ' HB2' ' A' ' 28' ' ' LYS . 51.1 t80 -124.27 133.43 53.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.998 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.425 ' HB2' ' CD1' ' A' ' 27' ' ' TYR . 0.0 OUTLIER 57.37 28.68 15.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.93 179.988 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.54 4.91 85.48 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.941 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -136.78 143.9 44.61 Favored Pre-proline 0 C--N 1.332 -0.163 0 CA-C-N 116.737 0.269 . . . . 0.0 111.008 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.39 130.12 14.68 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.523 2.148 . . . . 0.0 112.28 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.441 ' HB2' ' CE2' ' A' ' 34' ' ' PHE . 8.3 mtt -139.67 134.24 31.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.004 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.54 129.3 35.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.834 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.774 ' CB ' ' HB2' ' A' ' 90' ' ' ALA . 60.8 m-85 -138.73 158.23 44.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.972 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.562 ' C ' ' HB3' ' A' ' 90' ' ' ALA . 16.0 ptt180 -102.43 120.86 41.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.763 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.897 HD12 HG23 ' A' ' 92' ' ' ILE . 3.3 mm? -44.57 151.52 0.27 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.239 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.471 ' O ' HD23 ' A' ' 38' ' ' LEU . 3.9 pp -59.52 138.24 57.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.029 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.471 HD23 ' O ' ' A' ' 37' ' ' LEU . 27.4 mt -133.58 168.04 19.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.803 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.454 HG12 ' N ' ' A' ' 40' ' ' ASP . 38.5 t -61.94 156.59 3.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.016 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.454 ' N ' HG12 ' A' ' 39' ' ' VAL . 40.9 m-20 -83.58 129.52 34.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.018 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.762 HG23 ' HB2' ' A' ' 49' ' ' LYS . 72.9 m -115.79 93.52 37.9 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.741 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.407 ' HB2' ' HB3' ' A' ' 46' ' ' HIS . 26.4 Cg_exo -63.38 162.96 25.17 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.734 2.29 . . . . 0.0 112.298 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -73.52 -165.17 0.24 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.857 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.516 HG22 ' HD2' ' A' ' 45' ' ' LYS . 1.1 m -70.16 151.08 45.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.023 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.516 ' HD2' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER 61.55 22.08 12.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.081 -179.966 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.459 ' CB ' ' HD2' ' A' ' 47' ' ' PRO . 1.3 m-70 -121.19 168.01 11.96 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.634 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.459 ' HD2' ' CB ' ' A' ' 46' ' ' HIS . 2.5 Cg_endo -45.66 156.2 0.43 Allowed 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.856 2.371 . . . . 0.0 112.302 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.21 152.61 0.56 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.367 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.762 ' HB2' HG23 ' A' ' 41' ' ' THR . 2.5 ptpt -103.93 -177.77 3.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.932 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -101.31 -122.64 5.04 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.483 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.477 HG12 ' N ' ' A' ' 52' ' ' GLU . 20.6 t -121.04 159.2 23.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.887 0.375 . . . . 0.0 111.066 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.477 ' N ' HG12 ' A' ' 51' ' ' VAL . 2.8 mt-10 -103.35 176.38 5.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.918 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.19 94.91 0.54 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.886 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.438 ' CE1' ' CB ' ' A' ' 57' ' ' GLU . 1.5 p90 -82.48 -26.83 32.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.073 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 152.07 -153.44 24.91 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.768 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.44 -2.87 13.11 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.666 2.244 . . . . 0.0 112.793 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.438 ' CB ' ' CE1' ' A' ' 54' ' ' TYR . 0.1 OUTLIER -50.07 -27.63 5.9 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.778 0.323 . . . . 0.0 111.042 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.51 -31.64 62.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.024 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.2 p -63.5 -28.61 70.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.956 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -55.13 -26.15 36.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.312 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -57.17 -31.53 65.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.076 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.485 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 44.6 p -87.11 -21.77 25.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.11 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.484 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 5.0 mtmt -89.18 -19.99 24.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.206 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.76 -64.26 1.17 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.779 -179.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 9.9 mmm -89.16 -52.97 4.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.8 -178.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . 0.485 ' HB3' ' O ' ' A' ' 62' ' ' THR . 83.5 t90 -62.11 -15.54 46.11 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.484 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 22.4 tt0 -89.57 -51.97 5.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.799 0.333 . . . . 0.0 111.15 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -80.02 -28.15 39.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.146 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -108.07 150.91 26.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.837 0.351 . . . . 0.0 111.186 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.8 mtpt -98.28 96.46 8.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.828 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.23 125.11 22.62 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.207 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.839 HD11 ' O ' ' A' ' 12' ' ' ALA . 0.3 OUTLIER -88.01 154.1 3.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.264 179.263 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -134.28 151.36 51.23 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.431 ' HB ' ' O ' ' A' ' 10' ' ' GLU . 7.5 p -126.47 153.22 34.86 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.7 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.663 ' CD ' HD11 ' A' ' 25' ' ' LEU . 2.5 mp0 -100.98 166.86 10.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.904 0.383 . . . . 0.0 111.166 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.95 ' CG ' HD21 ' A' ' 7' ' ' LEU . 6.3 m-30 -93.0 168.1 11.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.875 -179.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -96.89 91.91 5.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.715 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.706 ' HG3' HD12 ' A' ' 89' ' ' LEU . 0.1 OUTLIER -77.85 -28.14 50.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.96 -179.877 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 68.21 25.17 74.68 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.38 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.06 84.49 2.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.876 0.369 . . . . 0.0 110.587 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 61.0 ttt180 -50.95 100.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.07 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.703 HG21 ' C ' ' A' ' 87' ' ' ARG . 7.4 p -58.79 120.9 9.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.596 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -115.31 -45.44 2.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.374 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.09 -50.33 11.11 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.198 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -133.0 -35.04 1.07 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.233 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 97.73 46.87 2.21 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.815 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.703 ' C ' HG21 ' A' ' 82' ' ' THR . 21.9 mtm180 -133.47 99.16 4.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.837 0.351 . . . . 0.0 111.307 -179.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -85.07 -121.46 1.03 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.371 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.706 HD12 ' HG3' ' A' ' 78' ' ' LYS . 6.2 mt -128.18 128.19 44.32 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.843 0.354 . . . . 0.0 110.965 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.774 ' HB2' ' CB ' ' A' ' 34' ' ' PHE . . . -111.56 148.67 32.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.263 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.51 ' CZ ' ' CG ' ' A' ' 76' ' ' PHE . 1.6 m-85 -137.07 158.28 44.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.339 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.897 HG23 HD12 ' A' ' 36' ' ' LEU . 2.0 pp -124.85 111.75 29.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.862 0.363 . . . . 0.0 111.623 -179.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -98.71 134.44 41.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.602 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.47 110.84 22.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.286 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.2 t0 47.82 30.47 1.91 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.168 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.43 131.96 0.32 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.352 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 37.9 tttt -86.86 103.52 15.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.777 0.322 . . . . 0.0 110.901 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -92.35 130.32 38.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.82 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 21.4 t -88.69 149.96 3.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.091 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 18.1 p30 -121.2 174.7 6.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.91 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -131.36 -53.29 1.02 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.908 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -149.99 111.98 4.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.131 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -107.5 -31.95 7.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.9 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 3.5 m -122.51 103.36 13.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.005 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -155.32 60.47 0.63 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.916 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 69.03 -67.25 0.22 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.945 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.589 ' C ' HD12 ' A' ' 108' ' ' LEU . . . -58.26 -34.45 74.15 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.511 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.589 HD12 ' C ' ' A' ' 107' ' ' GLY . 9.2 mp -118.65 60.32 0.8 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.964 0.411 . . . . 0.0 110.822 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 62.96 144.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.137 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 2.4 tmtt? . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.842 -179.956 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.769 0.319 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.0 t -103.77 94.53 5.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.85 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.7 m -102.54 146.68 27.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.952 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.43 152.62 40.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.878 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -59.7 120.45 9.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.899 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.14 150.98 36.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.069 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.458 HD22 ' O ' ' A' ' 75' ' ' GLU . 2.9 pp -73.1 157.0 38.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.958 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 5.2 m170 -80.07 124.81 29.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.711 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 ptpt -101.09 107.73 19.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.939 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -155.14 120.84 2.62 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.796 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.414 ' N ' ' HG2' ' A' ' 73' ' ' GLU . 84.2 Cg_endo -78.72 146.81 21.4 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.299 1.999 . . . . 0.0 112.124 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.814 ' HB1' ' O ' ' A' ' 26' ' ' MET . . . -127.83 -86.78 0.57 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.347 -179.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.657 HG23 ' O ' ' A' ' 12' ' ' ALA . 0.1 OUTLIER 167.57 119.77 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.678 0.275 . . . . 0.0 110.991 -179.908 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.725 ' HA ' HD12 ' A' ' 25' ' ' LEU . 10.9 tp -85.8 155.84 20.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.202 179.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.768 HD11 ' HG3' ' A' ' 26' ' ' MET . 12.7 mt -125.2 -72.34 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -120.23 146.51 45.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.893 0.377 . . . . 0.0 111.289 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.865 ' HA ' HG12 ' A' ' 23' ' ' VAL . . . -127.1 97.94 5.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.941 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.593 HD11 ' CB ' ' A' ' 21' ' ' ASP . 5.7 pt -64.62 -164.23 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.108 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -69.14 63.4 0.13 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.644 0.259 . . . . 0.0 111.499 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 42.58 70.21 0.52 Allowed Glycine 0 CA--C 1.519 0.289 0 C-N-CA 121.23 -0.51 . . . . 0.0 113.295 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.593 ' CB ' HD11 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -147.09 -39.57 0.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.592 0.234 . . . . 0.0 111.128 179.818 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.7 t -169.5 120.74 0.7 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.867 0.365 . . . . 0.0 111.144 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.865 HG12 ' HA ' ' A' ' 17' ' ' ALA . 33.6 m -117.66 131.73 69.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.885 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.403 ' HB3' ' HB ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -79.13 147.35 32.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.924 0.392 . . . . 0.0 111.209 -179.572 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.725 HD12 ' HA ' ' A' ' 14' ' ' LEU . 2.1 tp -141.01 125.37 17.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.82 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.814 ' O ' ' HB1' ' A' ' 12' ' ' ALA . 7.7 mtt -72.92 99.82 2.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.821 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -125.67 126.94 45.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.965 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.53 33.23 20.65 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.085 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.21 20.67 73.35 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.457 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.412 ' HA ' ' HD3' ' A' ' 31' ' ' PRO . 8.3 mt-30 -134.66 119.71 14.08 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.542 0.21 . . . . 0.0 110.84 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 30' ' ' GLN . 34.1 Cg_exo -59.72 133.52 51.77 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.401 2.067 . . . . 0.0 112.431 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.608 ' HB3' ' CE2' ' A' ' 34' ' ' PHE . 15.2 mmt -132.33 110.16 10.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.155 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.602 HG23 ' O ' ' A' ' 33' ' ' THR . 8.8 t -120.69 86.3 2.55 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -179.125 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.608 ' CE2' ' HB3' ' A' ' 32' ' ' MET . 1.7 p90 -142.09 106.26 4.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.438 177.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.641 ' HG3' ' HB1' ' A' ' 90' ' ' ALA . 13.4 ttp180 -140.55 97.08 3.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.634 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.926 HD11 ' HA2' ' A' ' 88' ' ' GLY . 0.5 OUTLIER -142.54 88.78 2.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.894 0.378 . . . . 0.0 110.75 178.971 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.732 ' C ' HD13 ' A' ' 38' ' ' LEU . 0.9 OUTLIER -133.03 93.73 3.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.794 180.0 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.732 HD13 ' C ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -148.48 177.05 9.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.841 179.902 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 16.1 m -93.92 144.42 9.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.165 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -105.43 128.48 53.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.906 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.617 HG21 ' HG3' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -105.34 147.78 35.16 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.859 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -72.06 147.8 49.46 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.643 2.228 . . . . 0.0 112.288 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -103.01 32.99 3.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.886 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -106.78 113.28 26.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.9 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 68.99 -67.37 0.22 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.046 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 42.9 m-70 -84.01 143.14 42.4 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.929 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.07 155.97 42.65 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.614 2.209 . . . . 0.0 112.356 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -66.0 152.04 45.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.835 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.617 ' HG3' HG21 ' A' ' 41' ' ' THR . 0.0 OUTLIER -155.55 29.4 0.38 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.025 -179.979 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -105.25 -53.32 0.79 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.49 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.8 t -101.63 85.81 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.776 0.322 . . . . 0.0 111.133 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.0 150.96 26.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.894 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.56 94.61 0.43 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.857 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -56.22 -34.09 65.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.996 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 69.62 -147.64 45.58 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.635 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -54.19 -21.97 24.24 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.634 2.222 . . . . 0.0 112.603 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -54.18 -54.4 40.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.23 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.52 -52.23 66.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.249 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.3 m -62.35 -30.8 71.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.089 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.62 -30.47 71.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.232 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 35.3 t80 -71.97 -42.07 66.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.041 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.432 ' CA ' ' HB3' ' A' ' 66' ' ' TRP . 81.1 p -76.11 -48.82 19.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.928 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.473 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -53.8 -21.33 7.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.442 -179.949 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.51 -60.86 1.85 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.301 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.491 ' O ' ' HB3' ' A' ' 69' ' ' ALA . 18.9 mtm -90.12 -51.97 5.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.91 -179.145 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . 0.652 ' CE2' HD23 ' A' ' 14' ' ' LEU . 64.3 t90 -59.99 -33.0 71.38 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -178.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.473 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -74.44 -50.19 19.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.741 0.305 . . . . 0.0 111.659 -179.365 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -79.8 -28.67 40.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.429 -179.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 65' ' ' MET . . . -108.47 148.5 30.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.224 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.9 mmmm -104.25 92.81 4.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.45 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -140.4 98.81 3.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.974 -179.776 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.671 HD13 ' N ' ' A' ' 72' ' ' ILE . 0.0 OUTLIER -139.66 131.44 33.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.18 0.514 . . . . 0.0 111.767 179.883 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.415 ' HB2' ' CG ' ' A' ' 93' ' ' TYR . 0.2 OUTLIER -165.18 178.97 6.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.014 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.7 t -100.9 136.36 32.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.756 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.458 ' O ' HD22 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -130.84 -5.91 4.02 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -179.363 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.687 ' HB2' HD23 ' A' ' 89' ' ' LEU . 2.7 p90 -92.14 137.86 32.01 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.129 0.49 . . . . 0.0 111.771 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.506 ' C ' HD22 ' A' ' 89' ' ' LEU . 9.2 p-10 -104.58 91.83 4.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.229 179.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.485 ' HA ' HD13 ' A' ' 89' ' ' LEU . 1.8 tptp -78.41 -71.93 0.4 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.193 -179.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 95.62 -27.74 14.77 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.244 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.9 -163.35 0.47 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.622 0.248 . . . . 0.0 110.568 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -119.1 18.27 13.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.474 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 16.4 p -109.07 120.04 41.34 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.909 0.385 . . . . 0.0 111.011 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.555 ' O ' ' HB3' ' A' ' 87' ' ' ARG . 4.7 m-20 -116.92 -52.15 2.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.316 0.579 . . . . 0.0 109.665 178.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 4.5 mtpt -111.19 -32.94 6.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.675 178.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 46.0 m-85 -87.69 46.48 1.38 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.884 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 130.44 44.04 0.18 Allowed Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.951 -0.642 . . . . 0.0 111.57 -179.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.555 ' HB3' ' O ' ' A' ' 83' ' ' ASP . 0.0 OUTLIER -57.8 132.97 54.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.137 0.494 . . . . 0.0 110.229 179.394 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.926 ' HA2' HD11 ' A' ' 36' ' ' LEU . . . -129.92 -35.72 0.42 Allowed Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.703 -0.761 . . . . 0.0 113.538 -179.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.687 HD23 ' HB2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER -103.46 148.47 25.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.819 0.342 . . . . 0.0 111.554 -179.14 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.78 ' HB2' ' N ' ' A' ' 36' ' ' LEU . . . -118.62 147.19 44.0 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.435 0.532 . . . . 0.0 112.435 -179.105 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -116.04 144.99 43.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.016 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.568 HG23 ' O ' ' A' ' 92' ' ' ILE . 1.3 tt -150.11 113.57 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.84 179.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.415 ' CG ' ' HB2' ' A' ' 73' ' ' GLU . 7.8 t80 -108.07 123.44 48.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.069 0.462 . . . . 0.0 111.156 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.712 ' HB3' ' HA ' ' A' ' 98' ' ' MET . . . -134.18 91.8 2.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.158 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 38.4 t70 50.39 58.07 5.9 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.484 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 80.64 -61.64 4.46 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.764 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 4.5 mtpm? -111.83 121.92 46.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.888 0.375 . . . . 0.0 110.942 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . 0.712 ' HA ' ' HB3' ' A' ' 94' ' ' ALA . 1.4 ptt? -72.28 110.04 6.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.733 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 29.3 m -127.58 127.57 68.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.249 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -90.87 -51.42 5.36 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.88 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -114.28 112.26 22.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.869 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.27 129.07 37.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.195 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 mp -127.05 164.9 20.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.887 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.5 t 61.47 96.25 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.024 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -135.74 -65.27 0.6 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.931 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -94.39 -34.33 12.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.943 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 115.16 36.08 1.26 Allowed Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.46 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.8 tp -84.31 -30.26 25.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.838 0.351 . . . . 0.0 110.979 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 61.67 162.3 0.07 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.168 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.842 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.299 0 CA-C-O 120.75 0.309 . . . . 0.0 111.118 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -104.63 101.55 11.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.791 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 25.8 t -65.81 129.03 38.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.915 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 64.0 p -91.54 144.54 25.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.939 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 31.8 mmtt -63.71 132.93 52.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.943 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -93.27 123.13 36.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.93 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.605 HD22 ' C ' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -70.05 157.13 38.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.93 -179.863 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -79.71 155.04 28.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.707 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.79 132.17 39.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.185 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.436 ' O ' HG23 ' A' ' 74' ' ' VAL . 7.1 tt0 -155.03 120.13 2.59 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.767 179.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -80.27 170.96 15.57 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.507 2.138 . . . . 0.0 112.685 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 1.065 ' HB3' HD23 ' A' ' 25' ' ' LEU . . . -136.57 -80.3 0.4 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.742 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.953 HG23 HD13 ' A' ' 72' ' ' ILE . 3.8 m 90.43 -69.36 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.651 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.49 87.02 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.818 0.342 . . . . 0.0 111.272 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.766 HG22 ' HA ' ' A' ' 25' ' ' LEU . 2.6 pp -125.48 -179.1 2.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.114 0.483 . . . . 0.0 111.726 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.9 mtpt -133.31 173.01 11.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.26 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -93.87 130.27 39.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.873 0.368 . . . . 0.0 111.255 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.616 HG21 ' CG2' ' A' ' 22' ' ' THR . 3.5 mp -140.34 157.98 25.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.974 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.462 ' N ' HG22 ' A' ' 18' ' ' ILE . 0.3 OUTLIER -98.03 146.52 25.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.975 -179.939 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 93.18 -129.95 10.11 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.519 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -126.16 89.32 3.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.728 0.299 . . . . 0.0 110.858 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.616 ' CG2' HG21 ' A' ' 18' ' ' ILE . 8.8 t -174.15 136.4 0.5 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.048 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.7 m -142.32 117.98 5.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.128 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.733 ' O ' HG22 ' A' ' 15' ' ' ILE . 1.4 tttp -79.68 97.68 6.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.444 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 1.065 HD23 ' HB3' ' A' ' 12' ' ' ALA . 0.4 OUTLIER -97.7 145.36 26.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.363 179.277 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.767 ' N ' ' HB1' ' A' ' 12' ' ' ALA . 14.2 ttt -72.86 99.32 2.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.922 0.392 . . . . 0.0 110.718 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -105.11 94.93 5.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.855 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 65.1 tttt 53.99 29.95 10.94 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.982 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 82.47 22.01 59.25 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.585 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -124.67 122.37 25.72 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-O 120.484 0.183 . . . . 0.0 110.753 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.61 127.53 23.97 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.416 2.077 . . . . 0.0 112.394 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.519 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 1.4 ptm -139.55 110.11 6.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.586 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.523 HG23 ' N ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -114.84 94.37 4.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.891 0.377 . . . . 0.0 111.51 -179.653 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 1.067 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 2.2 m-85 -141.14 143.34 34.21 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.11 0.481 . . . . 0.0 110.133 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.438 ' HA ' ' O ' ' A' ' 90' ' ' ALA . 6.3 ttt180 -143.63 98.12 3.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.013 -0.54 . . . . 0.0 112.063 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.635 HD22 HD22 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -142.72 88.68 2.08 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.318 178.91 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.671 ' O ' HD12 ' A' ' 37' ' ' LEU . 1.1 pp -125.89 84.04 2.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.783 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -133.12 122.8 24.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.843 -179.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 10.4 p -138.67 141.88 36.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.025 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -100.51 128.47 46.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.869 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 90.7 m -103.68 93.95 5.66 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.919 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.64 158.29 53.86 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.471 2.114 . . . . 0.0 112.206 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -177.7 125.46 0.13 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.883 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.71 119.57 24.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.948 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 74.9 2.56 4.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.721 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.451 ' CG ' ' HD2' ' A' ' 47' ' ' PRO . 0.3 OUTLIER -121.33 145.8 43.23 Favored Pre-proline 0 C--N 1.332 -0.191 0 CA-C-O 120.605 0.24 . . . . 0.0 110.982 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.451 ' HD2' ' CG ' ' A' ' 46' ' ' HIS . 56.0 Cg_endo -69.97 127.92 15.1 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.541 2.161 . . . . 0.0 112.205 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.7 pttm -58.83 143.98 45.73 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.927 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -124.56 45.05 2.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.867 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -60.75 -162.5 0.14 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.522 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.526 ' O ' HG13 ' A' ' 51' ' ' VAL . 11.6 p -78.84 117.78 25.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.717 0.294 . . . . 0.0 111.116 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -108.14 169.42 8.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.96 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.6 mtmm -84.56 93.44 8.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.918 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.46 ' HB3' ' CD1' ' A' ' 61' ' ' PHE . 12.3 m-85 -79.65 -33.6 41.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.965 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.534 ' N ' ' HB2' ' A' ' 61' ' ' PHE . . . -57.59 138.51 48.12 Favored Glycine 0 CA--C 1.508 -0.366 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.169 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.609 ' HD2' ' CB ' ' A' ' 60' ' ' ALA . 94.4 Cg_exo -38.29 -59.27 0.58 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 121.686 1.591 . . . . 0.0 112.843 -177.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -101.17 -78.05 0.53 Allowed 'General case' 0 C--N 1.348 0.508 0 C-N-CA 117.484 -1.686 . . . . 0.0 111.651 176.047 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -104.31 -74.74 0.64 Allowed 'General case' 0 C--N 1.346 0.415 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 176.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.546 ' O ' ' N ' ' A' ' 61' ' ' PHE . 89.4 p -100.59 -14.75 18.05 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 113.009 -1.905 . . . . 0.0 114.141 -178.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.609 ' CB ' ' HD2' ' A' ' 56' ' ' PRO . . . -37.0 -16.2 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -175.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.546 ' N ' ' O ' ' A' ' 59' ' ' SER . 5.6 t80 -52.63 -42.4 64.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 118.416 0.553 . . . . 0.0 111.379 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.446 ' HA ' ' HB2' ' A' ' 66' ' ' TRP . 32.9 p -82.38 -43.14 17.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.85 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.05 -20.12 15.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.507 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 44.8 mmtt -86.84 -63.73 1.26 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.768 0.318 . . . . 0.0 111.187 -179.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 2.8 ttp -89.27 -55.31 3.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.197 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . 0.861 ' CZ2' HG23 ' A' ' 72' ' ' ILE . 0.6 OUTLIER -51.4 -26.64 8.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.57 -179.738 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -94.06 -36.77 11.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.44 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -79.98 -28.15 39.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.347 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.649 ' HB3' ' HD3' ' A' ' 71' ' ' LYS . . . -108.3 150.97 26.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.094 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.31 92.96 9.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.009 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.649 ' HD3' ' HB3' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -160.35 98.86 1.29 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.923 179.936 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.953 HD13 HG23 ' A' ' 13' ' ' THR . 1.6 mp -136.05 130.96 49.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.963 0.411 . . . . 0.0 111.462 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -151.76 157.0 41.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.671 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.981 HG13 HD22 ' A' ' 25' ' ' LEU . 0.6 OUTLIER -136.17 153.08 31.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.933 0.397 . . . . 0.0 111.194 -179.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.584 ' HA ' HD11 ' A' ' 7' ' ' LEU . 1.8 mt-10 -163.55 78.66 0.42 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.701 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.605 ' C ' HD22 ' A' ' 7' ' ' LEU . 26.3 p90 -142.7 158.86 43.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.148 0.499 . . . . 0.0 111.523 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.23 162.76 4.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.411 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 67.3 mttt -50.55 -26.88 5.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.243 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.2 40.97 54.85 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.813 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -91.32 51.0 1.83 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.956 0.408 . . . . 0.0 110.799 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -122.68 -39.19 2.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.123 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.838 HG21 ' O ' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -59.44 122.2 13.39 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.078 0.466 . . . . 0.0 111.047 -179.827 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -115.46 -47.76 2.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.86 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.61 -61.06 2.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.113 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -80.97 -35.47 32.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.155 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 81.76 25.59 52.7 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.082 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.838 ' O ' HG21 ' A' ' 82' ' ' THR . 4.3 mtp85 -131.97 107.07 8.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.849 0.356 . . . . 0.0 110.645 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.472 ' O ' ' O ' ' A' ' 87' ' ' ARG . . . -54.29 -150.71 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.228 0 CA-C-N 115.736 -0.665 . . . . 0.0 113.125 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.635 HD22 HD22 ' A' ' 36' ' ' LEU . 0.5 OUTLIER -128.32 132.92 48.62 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 122.778 -0.248 . . . . 0.0 111.377 -179.223 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 1.067 ' HB3' ' O ' ' A' ' 34' ' ' PHE . . . -128.76 154.84 45.98 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 120.35 -0.54 . . . . 0.0 112.134 178.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.468 ' CD1' ' O ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -117.8 127.12 53.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.81 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 8.6 pt -79.9 130.85 35.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.129 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -117.58 117.93 30.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.836 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.41 104.58 16.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.051 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.404 ' CA ' ' HB2' ' A' ' 71' ' ' LYS . 0.4 OUTLIER 64.63 36.31 8.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.946 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 53.82 97.61 0.01 OUTLIER Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.625 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -91.09 102.27 15.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.826 0.346 . . . . 0.0 110.961 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.08 116.59 31.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.836 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 21.0 t 68.61 -68.0 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.173 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -131.18 -177.12 4.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.959 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -112.27 31.48 6.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.9 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -110.54 -167.88 1.24 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.201 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 11.0 tp 63.08 144.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.917 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.5 t 63.36 81.48 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.066 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.62 -44.88 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.903 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -114.44 32.75 5.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.842 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -166.12 -74.41 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.505 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.1 tp -64.43 -32.5 74.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.803 0.335 . . . . 0.0 110.824 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -63.66 97.37 0.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.99 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.315 -0.85 . . . . 0.0 110.893 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.81 0.338 . . . . 0.0 110.997 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.28 125.37 53.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.881 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.5 m -104.97 134.6 47.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.996 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 26.0 m -69.55 121.35 16.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.881 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.6 mtmm -72.67 146.49 46.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.994 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.72 149.27 47.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.74 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.5 mt -120.02 113.78 21.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.313 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 40.2 m-70 -71.59 99.9 2.17 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.38 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.813 ' HG3' HG23 ' A' ' 74' ' ' VAL . 5.7 mmtp -118.3 158.82 24.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.355 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -104.22 164.68 14.81 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.232 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.417 ' HA ' ' O ' ' A' ' 72' ' ' ILE . 86.6 Cg_endo -78.03 106.11 2.11 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.31 2.006 . . . . 0.0 112.857 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.513 ' O ' ' OG1' ' A' ' 13' ' ' THR . . . -158.19 124.5 4.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.389 179.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.711 ' HA ' ' HB3' ' A' ' 25' ' ' LEU . 76.1 m -176.31 24.88 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.888 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.535 ' O ' HD13 ' A' ' 15' ' ' ILE . 0.7 OUTLIER -98.09 83.81 3.17 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.013 -0.675 . . . . 0.0 110.06 178.983 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.535 HD13 ' O ' ' A' ' 14' ' ' LEU . 2.1 mm -127.63 -70.88 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.395 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt -145.61 140.98 27.76 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.933 179.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.86 133.84 39.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.966 0.413 . . . . 0.0 111.622 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.482 HG22 ' N ' ' A' ' 19' ' ' ASP . 16.5 mt -153.16 159.31 3.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.781 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.482 ' N ' HG22 ' A' ' 18' ' ' ILE . 0.5 OUTLIER -67.76 172.25 5.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.864 0.364 . . . . 0.0 111.042 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.466 ' CA ' ' HB2' ' A' ' 36' ' ' LEU . . . -69.73 65.85 0.63 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.835 -0.697 . . . . 0.0 112.472 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -148.18 -52.16 0.18 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.041 0.448 . . . . 0.0 110.143 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.477 HG23 HG21 ' A' ' 18' ' ' ILE . 0.7 OUTLIER -143.19 106.48 4.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.818 179.768 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.475 HG22 ' HB ' ' A' ' 18' ' ' ILE . 23.2 t -130.78 128.09 62.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.324 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.449 ' C ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -92.59 144.35 25.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.183 0.516 . . . . 0.0 111.944 -179.093 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.897 HD11 ' CE1' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -132.28 165.33 24.42 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.986 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.436 ' N ' HD11 ' A' ' 15' ' ' ILE . 6.7 mtt -77.18 98.62 5.15 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.446 ' HB2' HD23 ' A' ' 25' ' ' LEU . 5.6 t80 -128.17 113.94 16.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.074 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 52.01 26.25 3.63 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.95 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.31 13.82 76.92 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.779 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -124.86 140.88 36.73 Favored Pre-proline 0 C--N 1.332 -0.16 0 CA-C-O 120.666 0.27 . . . . 0.0 111.024 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -68.16 135.78 35.56 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.481 2.12 . . . . 0.0 111.973 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.741 ' SD ' HD21 ' A' ' 89' ' ' LEU . 2.5 mmt -145.11 110.46 5.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.244 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.715 ' O ' HD23 ' A' ' 89' ' ' LEU . 61.9 p -77.02 131.04 38.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.16 0.505 . . . . 0.0 112.277 -179.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.897 ' CE1' HD11 ' A' ' 25' ' ' LEU . 2.3 m-30 -106.57 158.73 16.71 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.976 179.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -115.64 148.08 40.07 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.348 179.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.682 HD12 ' OD1' ' A' ' 100' ' ' ASN . 0.1 OUTLIER -104.45 134.64 47.3 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.088 0.47 . . . . 0.0 111.682 -179.364 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.8 tp -144.25 133.74 23.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.618 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -96.58 148.56 22.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.812 0.339 . . . . 0.0 111.053 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.7 t -67.29 112.88 2.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.149 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -67.48 159.87 28.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.974 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.5 m -89.32 107.45 18.31 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.913 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -68.37 146.73 69.8 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.469 2.113 . . . . 0.0 112.326 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -130.85 173.84 10.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.823 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -78.92 100.78 7.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.834 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? 57.87 21.18 7.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.141 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -121.21 156.6 57.23 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.935 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.42 118.47 5.08 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.6 2.2 . . . . 0.0 112.236 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.2 pptp? -69.91 116.73 10.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.007 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -174.03 164.3 4.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.888 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -159.67 -163.48 13.44 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.416 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 29.7 m -71.2 140.13 18.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.694 0.283 . . . . 0.0 111.09 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.1 118.62 37.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.784 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -57.82 93.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.86 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -92.97 36.06 1.04 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.161 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -104.63 158.43 16.4 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.415 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.87 -15.64 36.78 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.571 2.181 . . . . 0.0 112.463 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.8 pm0 -55.87 -27.36 51.35 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.858 0.361 . . . . 0.0 111.217 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.442 ' HB3' ' HG3' ' A' ' 101' ' ' GLU . . . -58.31 -65.06 0.71 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.135 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.35 -38.54 89.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.832 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.51 -32.07 73.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.016 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.403 ' CZ ' ' HB3' ' A' ' 94' ' ' ALA . 0.2 OUTLIER -59.34 -51.78 68.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.641 179.905 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.441 ' HB ' ' HB3' ' A' ' 66' ' ' TRP . 51.4 p -58.2 -45.54 87.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.783 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.402 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 1.9 tttm -54.92 -19.83 7.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.34 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.19 -63.38 1.31 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.935 0.398 . . . . 0.0 111.204 -179.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.5 ' O ' ' N ' ' A' ' 69' ' ' ALA . 2.1 mtt -87.93 -58.87 2.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.223 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . 0.441 ' HB3' ' HB ' ' A' ' 62' ' ' THR . 74.9 t90 -51.55 -32.0 26.54 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.402 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 0.5 OUTLIER -94.44 -52.66 4.23 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -179.168 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -79.47 -28.29 41.54 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.746 0.308 . . . . 0.0 111.625 -178.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 65' ' ' MET . . . -107.69 151.21 25.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.597 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.2 mtmt -103.41 97.25 7.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.844 0.354 . . . . 0.0 111.94 -178.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.455 ' HD3' ' CB ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -166.25 96.63 0.59 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.712 178.79 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.634 HG21 ' CB ' ' A' ' 13' ' ' THR . 1.3 mp -141.47 103.83 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.148 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -136.84 151.43 49.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.845 0.355 . . . . 0.0 111.796 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.813 HG23 ' HG3' ' A' ' 9' ' ' LYS . 2.0 m -103.81 153.63 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.793 -179.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.56 -75.41 0.61 Allowed 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.989 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -143.39 146.33 33.4 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.852 0.358 . . . . 0.0 111.007 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.909 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 1.9 p30 -59.12 148.29 31.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.093 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.411 ' NZ ' ' HB2' ' A' ' 80' ' ' GLN . 0.2 OUTLIER -101.2 -61.35 1.38 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.835 179.872 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 100.89 41.17 2.71 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.884 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.411 ' HB2' ' NZ ' ' A' ' 78' ' ' LYS . 2.8 mt-30 -123.97 150.77 44.41 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.855 0.36 . . . . 0.0 110.922 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 69.1 9.97 7.64 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.24 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.473 ' CB ' ' O ' ' A' ' 85' ' ' TYR . 0.5 OUTLIER -109.3 148.42 31.06 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.658 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -84.69 -52.57 5.98 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.073 0.463 . . . . 0.0 110.079 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.9 mttt -110.51 -57.29 2.24 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 177.065 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.737 ' O ' ' N ' ' A' ' 87' ' ' ARG . 65.9 m-85 -133.35 -37.7 0.95 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 113.879 -1.51 . . . . 0.0 107.985 176.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.454 ' HA3' ' HB ' ' A' ' 82' ' ' THR . . . 44.28 -36.71 0.0 OUTLIER Glycine 0 N--CA 1.472 1.086 0 C-N-CA 125.188 1.375 . . . . 0.0 115.662 177.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.737 ' N ' ' O ' ' A' ' 85' ' ' TYR . 0.1 OUTLIER -142.69 95.88 2.85 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 176.912 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.813 ' C ' HD13 ' A' ' 89' ' ' LEU . . . -77.42 13.03 12.04 Favored Glycine 0 C--N 1.313 -0.75 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.179 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.813 HD13 ' C ' ' A' ' 88' ' ' GLY . 0.0 OUTLIER -128.2 149.81 50.29 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 122.787 0.435 . . . . 0.0 110.229 -179.17 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.909 ' HB2' ' HA ' ' A' ' 77' ' ' ASP . . . -101.49 -178.31 3.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.023 0.44 . . . . 0.0 111.861 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.55 ' HB3' ' HA ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -71.97 145.69 48.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.834 -178.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.67 ' O ' HD12 ' A' ' 92' ' ' ILE . 1.3 pp -96.55 160.31 2.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.99 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -110.91 119.13 38.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.013 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.403 ' HB3' ' CZ ' ' A' ' 61' ' ' PHE . . . -97.44 93.74 6.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.082 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.416 ' N ' ' HG3' ' A' ' 71' ' ' LYS . 12.3 t0 67.05 52.46 0.87 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.873 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 105.37 -81.99 0.33 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.598 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.71 135.99 53.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.821 0.343 . . . . 0.0 111.087 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.06 139.8 34.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.855 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.441 HG12 ' N ' ' A' ' 100' ' ' ASN . 22.0 t -82.14 156.02 4.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.141 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.682 ' OD1' HD12 ' A' ' 36' ' ' LEU . 0.8 OUTLIER -95.87 167.48 11.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.882 179.936 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.442 ' HG3' ' HB3' ' A' ' 58' ' ' ALA . 0.3 OUTLIER -177.42 154.43 1.0 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.804 179.997 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -128.88 35.22 4.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.157 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 59.33 28.03 17.26 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.998 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 23.5 t 68.32 -67.66 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.273 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 3.9 ttt-85 62.16 33.24 16.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.002 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -173.56 80.88 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.902 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 155.32 -28.12 0.62 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.522 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 20.6 mt -108.72 -54.43 2.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.832 0.349 . . . . 0.0 110.861 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -108.78 -170.49 1.67 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.034 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.884 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.693 0.283 . . . . 0.0 111.024 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 66.5 p -108.86 103.14 12.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.827 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.7 t -105.44 106.81 17.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.949 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.1 p -110.37 135.14 51.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.961 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.93 144.59 54.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.869 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.7 mtpt -114.53 119.83 38.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.913 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.665 HD13 ' H ' ' A' ' 8' ' ' HIS . 0.2 OUTLIER -108.07 153.98 22.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.827 179.812 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.665 ' H ' HD13 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -93.48 147.24 23.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.864 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.27 122.76 21.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.103 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -146.11 131.64 9.28 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.514 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.568 ' HA ' ' HA ' ' A' ' 73' ' ' GLU . 84.8 Cg_endo -79.75 171.13 16.0 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.293 1.995 . . . . 0.0 112.732 -179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -153.65 -136.18 0.06 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.717 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.788 HG22 ' HB2' ' A' ' 26' ' ' MET . 3.5 t -162.24 178.44 8.73 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.743 0.306 . . . . 0.0 110.799 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.645 HD13 ' N ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -97.16 94.82 7.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.988 0.423 . . . . 0.0 111.076 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.9 mt -85.84 -68.63 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.007 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.418 ' HB2' ' CG ' ' A' ' 24' ' ' LYS . 4.4 ttpp -110.05 169.74 8.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.472 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -87.12 148.31 25.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.049 0.452 . . . . 0.0 111.85 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.883 HD11 ' HG3' ' A' ' 35' ' ' ARG . 5.9 tp -111.35 119.04 58.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.156 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -118.24 28.93 8.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.835 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.38 38.17 29.65 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.345 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -147.12 -49.47 0.19 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.747 0.308 . . . . 0.0 110.834 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 71.8 p -157.97 139.58 13.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.17 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.767 ' HB ' HD13 ' A' ' 18' ' ' ILE . 12.5 p -142.43 114.05 3.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.693 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.418 ' CG ' ' HB2' ' A' ' 16' ' ' LYS . 4.4 ptpt -91.02 125.98 35.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.386 -179.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 21.6 mt -124.49 157.0 36.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.606 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.788 ' HB2' HG22 ' A' ' 13' ' ' THR . 0.0 OUTLIER -72.99 99.89 2.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.905 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.615 ' CD2' HG21 ' A' ' 74' ' ' VAL . 24.9 t80 -124.37 108.47 12.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.705 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 62.7 23.75 14.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.036 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 89.96 -14.14 62.73 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.92 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -110.66 144.82 31.03 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.838 0.319 . . . . 0.0 111.089 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -73.6 151.65 47.27 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.513 2.142 . . . . 0.0 112.199 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.456 ' HB3' ' CD1' ' A' ' 34' ' ' PHE . 1.7 mmm -145.15 113.77 6.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.093 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 37.2 p -89.81 86.68 6.72 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.411 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.457 ' HB2' ' O ' ' A' ' 88' ' ' GLY . 1.9 p90 -141.31 118.76 11.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.071 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.883 ' HG3' HD11 ' A' ' 18' ' ' ILE . 0.0 OUTLIER -139.89 120.27 13.98 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.347 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.736 HD13 HD13 ' A' ' 89' ' ' LEU . 0.4 OUTLIER -143.11 146.51 33.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.12 178.201 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.452 ' O ' HG22 ' A' ' 39' ' ' VAL . 0.5 OUTLIER -144.17 135.08 25.21 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.935 0.398 . . . . 0.0 111.27 -179.932 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.7 tt -59.3 96.94 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.772 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.452 HG22 ' O ' ' A' ' 37' ' ' LEU . 5.2 m -126.91 122.07 59.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.182 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -135.45 130.36 34.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.852 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 34.5 m -106.26 121.92 43.87 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.859 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -56.15 137.0 78.06 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.489 2.126 . . . . 0.0 112.252 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 177.36 -169.42 0.07 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.608 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 30.6 p -60.91 140.16 57.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.433 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.42 ' O ' ' HD3' ' A' ' 47' ' ' PRO . 0.1 OUTLIER 62.54 -160.1 0.31 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -179.664 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -110.45 80.6 2.05 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 120.793 0.33 . . . . 0.0 111.186 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.42 ' HD3' ' O ' ' A' ' 45' ' ' LYS . 89.3 Cg_endo -84.3 155.6 12.62 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.732 2.288 . . . . 0.0 112.342 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 mttt -128.14 96.83 4.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.712 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -162.4 155.88 20.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.887 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -176.83 32.14 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.507 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.634 ' O ' HG13 ' A' ' 51' ' ' VAL . 7.7 p -121.17 83.37 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.908 0.385 . . . . 0.0 110.997 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -96.37 139.78 32.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.849 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.62 90.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.836 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.687 ' HE1' ' HB2' ' A' ' 58' ' ' ALA . 0.1 OUTLIER -130.74 26.07 5.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.189 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 75.03 -147.31 36.19 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.852 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.1 -2.67 12.63 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.86 2.374 . . . . 0.0 113.012 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -43.81 -30.65 0.69 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.84 0.352 . . . . 0.0 111.593 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.687 ' HB2' ' HE1' ' A' ' 54' ' ' TYR . . . -73.88 -60.9 2.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.966 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.6 p -62.07 -19.11 62.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.123 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -51.3 -29.06 13.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.771 0.32 . . . . 0.0 111.418 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -60.18 -63.87 1.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.809 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.447 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 0.6 OUTLIER -66.92 -34.79 78.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.749 -179.978 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.418 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 13.2 mttm -51.15 -19.85 1.31 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.627 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -81.02 -61.85 1.84 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.83 0.347 . . . . 0.0 111.013 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.443 ' O ' ' N ' ' A' ' 69' ' ' ALA . 5.7 mmt -88.68 -52.56 5.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.964 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . 0.447 ' HB3' ' O ' ' A' ' 62' ' ' THR . 68.2 t90 -53.66 -27.37 27.07 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.69 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.418 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -94.51 -56.42 2.81 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -179.315 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -79.88 -28.4 39.91 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 65' ' ' MET . . . -104.59 144.08 32.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.826 0.346 . . . . 0.0 110.866 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -96.59 92.6 6.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.153 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.464 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -162.06 98.11 1.05 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.015 179.536 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 2.7 mp -139.54 133.09 37.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.166 0.507 . . . . 0.0 111.96 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.589 ' HB2' ' CG ' ' A' ' 93' ' ' TYR . 10.3 mt-10 -146.7 170.09 17.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.353 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.615 HG21 ' CD2' ' A' ' 27' ' ' TYR . 27.2 m -108.14 131.99 57.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.977 0.417 . . . . 0.0 111.546 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -91.49 -164.33 1.16 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.845 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.3 p90 -92.89 136.39 33.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.056 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.635 ' HA ' ' HB3' ' A' ' 90' ' ' ALA . 36.6 p30 -103.94 162.0 13.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.044 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.0 ttmt -58.92 -66.45 0.5 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.946 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 91.23 27.72 17.35 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.588 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -129.0 -54.35 1.21 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.836 0.35 . . . . 0.0 110.984 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.87 97.9 9.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.83 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.489 ' HB ' ' HA2' ' A' ' 86' ' ' GLY . 1.6 p -83.49 171.04 13.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.726 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -115.23 -51.79 2.7 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 44.3 tttm -110.83 -64.34 1.29 Allowed 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -179.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -133.77 2.45 3.43 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.489 ' HA2' ' HB ' ' A' ' 82' ' ' THR . . . 128.15 51.01 0.14 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.307 -0.949 . . . . 0.0 112.601 -179.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 4.2 mtp85 -104.51 98.76 8.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.707 0.289 . . . . 0.0 110.991 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.457 ' O ' ' HB2' ' A' ' 34' ' ' PHE . . . -54.16 108.91 0.97 Allowed Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 178.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.736 HD13 HD13 ' A' ' 36' ' ' LEU . 0.2 OUTLIER -77.21 96.47 4.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.423 0.63 . . . . 0.0 112.63 -177.588 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.635 ' HB3' ' HA ' ' A' ' 77' ' ' ASP . . . -174.78 113.66 0.15 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.145 177.299 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.745 ' CD2' HG11 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -145.67 102.93 3.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.527 179.993 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.621 HD13 ' O ' ' A' ' 91' ' ' TYR . 32.1 mm -150.04 107.7 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.181 178.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.589 ' CG ' ' HB2' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -153.24 135.43 14.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.036 178.848 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -134.42 99.75 4.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.875 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.459 ' CA ' ' HB2' ' A' ' 71' ' ' LYS . 4.4 t0 57.89 41.55 24.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.822 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 60.78 42.0 99.32 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.493 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.82 100.58 10.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.849 0.357 . . . . 0.0 110.881 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.72 145.6 24.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.847 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 11.2 p -60.45 -31.91 49.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.992 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -139.61 164.51 29.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.937 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -104.23 132.53 50.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.921 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -114.53 -57.95 2.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.099 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 3.1 pp -111.04 161.18 16.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.924 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 6.5 m -134.84 167.6 25.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.182 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 70.5 mtt85 -101.1 160.22 14.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.861 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -98.75 147.73 24.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.888 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.9 -79.51 1.84 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.455 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.459 ' O ' ' HB3' ' A' ' 109' ' ' ALA . 2.0 mm? -69.46 -22.51 63.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.771 0.319 . . . . 0.0 111.086 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.459 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . 70.37 -64.8 0.35 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.12 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.166 -0.921 . . . . 0.0 110.846 179.956 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.77 0.319 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -130.18 107.88 9.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.859 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.01 109.7 8.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.884 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.86 123.03 43.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.872 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.4 149.89 27.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.973 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 mmmt -72.96 118.16 15.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.898 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.99 157.09 35.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.902 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -89.12 142.06 27.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.765 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.4 mmmt -83.62 107.97 16.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.017 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -140.33 133.74 15.08 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.698 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.425 ' HA ' ' HA ' ' A' ' 73' ' ' GLU . 98.4 Cg_endo -79.55 112.58 2.98 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.435 2.09 . . . . 0.0 112.636 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.647 ' HB1' ' O ' ' A' ' 26' ' ' MET . . . -166.07 104.6 0.66 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.026 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.818 HG23 HD22 ' A' ' 25' ' ' LEU . 0.3 OUTLIER -174.14 9.0 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.253 -0.43 . . . . 0.0 112.063 179.816 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.7 tp -98.67 85.08 3.26 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 120.691 -0.403 . . . . 0.0 111.346 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.608 HD11 ' N ' ' A' ' 26' ' ' MET . 32.5 mt -126.8 -68.43 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.91 178.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.9 tptt -130.99 122.76 27.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.297 178.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.879 ' HB2' ' CZ3' ' A' ' 66' ' ' TRP . . . -76.91 120.86 22.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.086 0.47 . . . . 0.0 112.028 -178.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.67 HD13 ' O ' ' A' ' 17' ' ' ALA . 25.0 mm -147.51 158.59 8.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.221 179.344 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.481 ' N ' HG22 ' A' ' 18' ' ' ILE . 0.8 OUTLIER -67.82 -176.16 0.63 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.534 179.836 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -66.84 70.22 0.18 Allowed Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.079 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.422 ' N ' ' O ' ' A' ' 19' ' ' ASP . 8.6 t70 -147.71 -51.98 0.19 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.912 0.386 . . . . 0.0 110.623 -179.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.455 ' HA ' ' O ' ' A' ' 34' ' ' PHE . 1.5 t -154.55 106.38 2.72 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.578 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.566 HG23 ' HB2' ' A' ' 34' ' ' PHE . 2.6 m -132.67 113.92 21.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.898 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.431 ' HG3' HG21 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -79.94 138.75 37.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.13 0.491 . . . . 0.0 112.011 -178.575 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.818 HD22 HG23 ' A' ' 13' ' ' THR . 0.1 OUTLIER -121.6 127.33 50.77 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.035 179.409 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.647 ' O ' ' HB1' ' A' ' 12' ' ' ALA . 0.4 OUTLIER -72.83 99.59 2.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.93 0.395 . . . . 0.0 110.886 -179.753 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -117.38 114.4 23.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.806 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 59.91 28.15 17.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.812 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 82.66 18.98 64.67 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.72 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.34 128.07 21.03 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.656 0.228 . . . . 0.0 110.952 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -74.14 126.93 10.87 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.444 2.096 . . . . 0.0 112.227 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 18.5 mmt -119.17 110.73 17.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.167 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.4 HG23 ' OG1' ' A' ' 22' ' ' THR . 14.3 m -70.98 157.13 38.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.334 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.814 ' CE1' HD11 ' A' ' 25' ' ' LEU . 1.9 m-85 -120.33 158.97 25.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.581 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -116.57 148.31 41.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.979 0.418 . . . . 0.0 111.082 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.762 HD23 ' O ' ' A' ' 37' ' ' LEU . 6.2 tt -48.71 119.46 3.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.487 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.762 ' O ' HD23 ' A' ' 36' ' ' LEU . 1.9 pp -49.06 165.23 0.06 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.912 179.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.464 ' O ' ' O ' ' A' ' 37' ' ' LEU . 23.0 tp -31.99 156.68 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.2 t -61.37 133.74 26.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.778 -179.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.4 ' O ' ' HD3' ' A' ' 42' ' ' PRO . 6.3 p30 -137.04 165.7 25.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.307 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.509 HG23 ' H ' ' A' ' 49' ' ' LYS . 92.3 m -76.26 112.06 18.86 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.962 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.433 ' CG ' ' HB3' ' A' ' 46' ' ' HIS . 97.5 Cg_endo -84.3 163.29 13.07 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.867 2.378 . . . . 0.0 112.524 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -130.51 -41.86 1.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.367 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.525 HG23 ' O ' ' A' ' 44' ' ' THR . 7.1 t -60.93 100.36 0.11 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.854 0.359 . . . . 0.0 111.218 -179.503 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 44.92 20.86 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.334 179.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.433 ' HB3' ' CG ' ' A' ' 42' ' ' PRO . 2.5 m80 -121.88 127.68 25.89 Favored Pre-proline 0 C--N 1.33 -0.249 0 O-C-N 122.47 -0.144 . . . . 0.0 111.051 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -57.47 151.08 55.89 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.292 1.995 . . . . 0.0 112.148 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.75 166.11 5.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.909 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.509 ' H ' HG23 ' A' ' 41' ' ' THR . 0.3 OUTLIER -117.49 -81.45 0.62 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.964 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -151.43 -46.79 0.02 OUTLIER Glycine 0 C--N 1.332 0.319 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.776 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 31.6 m -70.87 169.53 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.88 0.371 . . . . 0.0 111.246 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -108.12 168.36 9.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.865 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.2 mttp -60.08 91.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.857 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -131.63 20.16 4.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.182 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 172.58 59.84 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.679 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -78.22 -27.68 5.3 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.517 2.145 . . . . 0.0 112.397 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.445 ' HG3' ' HB3' ' A' ' 60' ' ' ALA . 1.5 tp10 -65.04 -15.89 62.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.333 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -49.46 -33.49 14.37 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.835 0.35 . . . . 0.0 111.38 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -88.87 -24.1 22.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.042 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.445 ' HB3' ' HG3' ' A' ' 57' ' ' GLU . . . -76.16 -28.85 57.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.253 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -56.88 -48.01 79.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.939 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.577 ' HB ' HD11 ' A' ' 92' ' ' ILE . 1.3 t -64.63 -15.48 61.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.383 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.5 tttp -89.14 -66.47 0.92 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.414 ' O ' ' N ' ' A' ' 68' ' ' ASN . 8.8 mttt -88.79 -64.34 1.16 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.978 0.418 . . . . 0.0 111.998 -178.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.416 ' O ' ' HB3' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -51.91 -21.53 3.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.745 -179.302 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . 0.879 ' CZ3' ' HB2' ' A' ' 17' ' ' ALA . 22.9 t90 -99.2 -37.34 9.33 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -179.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -94.11 -49.02 5.95 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -178.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.414 ' N ' ' O ' ' A' ' 64' ' ' LYS . 91.3 m-20 -79.72 -28.37 40.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.663 0.268 . . . . 0.0 111.565 -179.171 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 65' ' ' MET . . . -108.15 151.05 26.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.747 0.308 . . . . 0.0 111.092 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.2 mmtt -96.35 96.01 8.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.27 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.714 ' HB2' ' N ' ' A' ' 95' ' ' ASP . 0.0 OUTLIER -166.14 100.52 0.63 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.648 179.577 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.693 HD13 ' N ' ' A' ' 72' ' ' ILE . 0.0 OUTLIER -139.23 105.27 2.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.471 -179.659 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.425 ' HA ' ' HA ' ' A' ' 11' ' ' PRO . 2.6 mt-10 -128.73 169.7 14.19 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.249 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.527 HG22 HD13 ' A' ' 25' ' ' LEU . 21.1 t -115.18 147.4 18.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.852 179.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.42 ' HB2' ' CE2' ' A' ' 93' ' ' TYR . 4.8 tt0 -110.78 -69.95 0.84 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.696 0.284 . . . . 0.0 111.613 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -110.04 118.16 35.67 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.896 0.379 . . . . 0.0 111.371 -179.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -104.2 91.83 4.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.464 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -61.18 -83.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.043 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 91.86 -29.0 7.79 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.712 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -110.69 -38.35 5.18 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.785 0.326 . . . . 0.0 110.893 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.4 ttt-85 -75.99 63.39 1.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.81 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.414 ' CG2' ' HA2' ' A' ' 86' ' ' GLY . 10.4 p -87.7 151.09 23.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.712 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -114.97 -51.9 2.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.25 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.79 -64.03 1.32 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.866 0.365 . . . . 0.0 111.286 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -133.79 12.39 4.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.447 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.414 ' HA2' ' CG2' ' A' ' 82' ' ' THR . . . 128.08 0.75 6.41 Favored Glycine 0 CA--C 1.519 0.342 0 C-N-CA 120.518 -0.849 . . . . 0.0 112.963 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -107.77 98.98 8.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.953 0.406 . . . . 0.0 110.978 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -117.32 -85.47 1.11 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.274 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.2 tp -102.28 101.01 11.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.721 0.296 . . . . 0.0 110.676 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.707 ' HB1' ' CD2' ' A' ' 34' ' ' PHE . . . -152.24 137.75 17.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.923 0.392 . . . . 0.0 111.506 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -142.15 122.23 13.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.635 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.577 HD11 ' HB ' ' A' ' 62' ' ' THR . 2.7 pt -89.49 149.9 3.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.832 0.349 . . . . 0.0 111.275 -179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.499 ' CD1' ' HA2' ' A' ' 96' ' ' GLY . 0.0 OUTLIER -137.77 168.09 20.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.081 179.466 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.615 ' HB1' ' HG3' ' A' ' 71' ' ' LYS . . . -94.08 99.73 11.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.715 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.714 ' N ' ' HB2' ' A' ' 71' ' ' LYS . 1.9 t0 76.6 21.0 1.34 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.125 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.499 ' HA2' ' CD1' ' A' ' 93' ' ' TYR . . . 45.27 53.87 7.6 Favored Glycine 0 CA--C 1.517 0.184 0 C-N-CA 121.035 -0.602 . . . . 0.0 112.912 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.88 99.79 12.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.878 0.37 . . . . 0.0 110.93 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.87 137.22 32.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.803 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.8 m -104.26 92.68 2.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.11 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 12.1 p-10 -168.87 -41.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.934 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 62.25 108.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.902 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -129.12 -73.54 0.57 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.02 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 5.1 mp 58.98 106.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.942 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.617 HG21 ' HB2' ' A' ' 109' ' ' ALA . 21.5 t -96.44 -66.68 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.114 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.02 -49.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.857 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.51 -46.02 0.98 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.842 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 140.22 44.31 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.532 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.7 mp -137.95 -52.61 0.63 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.86 0.362 . . . . 0.0 110.896 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.617 ' HB2' HG21 ' A' ' 104' ' ' VAL . . . 59.46 85.14 0.1 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.131 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.9 mmtt . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.895 -179.95 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.786 0.326 . . . . 0.0 111.042 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.4 m -111.88 95.78 5.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.913 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 30.3 t -101.85 114.92 29.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.87 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.2 p -105.35 117.82 34.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.822 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.28 113.09 25.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.918 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.2 mtpt -116.53 140.59 49.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.897 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.573 HD13 ' H ' ' A' ' 8' ' ' HIS . 0.2 OUTLIER -101.96 151.19 22.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.942 -179.96 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.573 ' H ' HD13 ' A' ' 7' ' ' LEU . 13.7 t60 -120.56 88.92 3.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.675 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.72 158.18 29.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.01 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -104.76 158.6 31.67 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.714 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -78.87 157.31 27.42 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.426 2.084 . . . . 0.0 112.535 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.706 ' HB1' ' O ' ' A' ' 26' ' ' MET . . . -120.29 -90.25 0.58 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.318 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.662 HG23 ' O ' ' A' ' 12' ' ' ALA . 0.1 OUTLIER 175.67 164.24 0.33 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.89 0.376 . . . . 0.0 110.875 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.452 ' CB ' ' CZ2' ' A' ' 66' ' ' TRP . 1.7 pp -90.12 139.88 30.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.827 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.541 HD11 ' N ' ' A' ' 26' ' ' MET . 3.4 mt -125.08 -77.1 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.392 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.741 ' O ' HG13 ' A' ' 23' ' ' VAL . 18.9 mtpt -145.2 137.99 26.21 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.88 0.372 . . . . 0.0 110.961 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -126.35 106.3 9.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.984 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.691 HG23 ' H ' ' A' ' 19' ' ' ASP . 0.7 OUTLIER -51.28 -77.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.311 -179.858 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.691 ' H ' HG23 ' A' ' 18' ' ' ILE . 0.5 OUTLIER -118.16 -80.97 0.62 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.739 0.304 . . . . 0.0 110.841 179.896 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -174.71 33.5 0.1 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.528 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -122.08 -35.53 3.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.69 0.281 . . . . 0.0 111.039 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 t -147.03 139.58 24.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.808 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.741 HG13 ' O ' ' A' ' 16' ' ' LYS . 29.4 t -142.79 129.58 18.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.277 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.438 ' HA ' ' O ' ' A' ' 32' ' ' MET . 0.0 OUTLIER -79.65 143.68 34.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.203 -179.76 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.676 HD11 ' OH ' ' A' ' 91' ' ' TYR . 0.4 OUTLIER -136.52 165.01 26.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.645 179.797 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.706 ' O ' ' HB1' ' A' ' 12' ' ' ALA . 23.3 mmt -84.98 99.85 11.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.858 0.361 . . . . 0.0 110.87 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -115.63 95.7 5.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.868 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.6 mmtm 58.32 30.18 19.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.956 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 91.33 -14.07 64.73 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.629 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -99.31 141.42 22.81 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 120.694 0.283 . . . . 0.0 110.871 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.54 134.71 15.59 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.514 2.142 . . . . 0.0 112.249 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.455 ' HB3' ' CE1' ' A' ' 34' ' ' PHE . 3.5 mmt -129.19 110.54 12.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.926 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.72 86.75 4.15 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.918 -179.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.505 ' HB2' ' CD1' ' A' ' 91' ' ' TYR . 0.5 OUTLIER -137.78 107.11 6.1 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.779 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 tpt180 -140.38 127.72 21.22 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.481 HD22 ' O ' ' A' ' 89' ' ' LEU . 6.9 tp -143.12 111.06 5.99 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.349 178.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.676 HD11 ' HB1' ' A' ' 58' ' ' ALA . 0.6 OUTLIER -143.99 149.69 37.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.076 0.465 . . . . 0.0 111.603 -179.59 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -151.13 96.91 2.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.36 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.944 HG21 ' CD2' ' A' ' 61' ' ' PHE . 26.9 m -97.24 121.42 47.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.547 -179.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -137.14 96.19 3.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.796 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.518 HG22 ' HB2' ' A' ' 47' ' ' PRO . 0.5 OUTLIER -156.83 120.06 2.24 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.179 -179.88 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -57.52 163.24 8.94 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.467 2.111 . . . . 0.0 112.305 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -106.78 3.82 26.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.469 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.434 HG23 ' O ' ' A' ' 44' ' ' THR . 10.0 t -111.06 119.01 37.6 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.697 0.284 . . . . 0.0 110.916 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.17 -148.38 0.45 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.221 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.439 ' O ' ' CD2' ' A' ' 46' ' ' HIS . 0.3 OUTLIER -70.25 116.88 49.16 Favored Pre-proline 0 C--O 1.232 0.149 0 O-C-N 122.31 -0.243 . . . . 0.0 110.651 -179.877 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.518 ' HB2' HG22 ' A' ' 41' ' ' THR . 37.3 Cg_endo -66.13 105.87 0.91 Allowed 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.428 2.085 . . . . 0.0 112.645 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.43 96.71 4.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.589 179.443 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 50.57 96.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.958 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -123.46 -105.28 1.72 Allowed Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.735 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 27.7 m -70.9 147.09 11.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.729 0.299 . . . . 0.0 111.203 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -100.41 179.03 4.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.828 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -81.36 90.98 6.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.93 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -87.81 -32.48 19.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.824 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 130.42 -81.66 0.33 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.469 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -52.43 -28.72 36.69 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.602 2.201 . . . . 0.0 112.325 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -67.44 -36.12 80.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.854 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.676 ' HB1' HD11 ' A' ' 37' ' ' LEU . . . -72.82 -32.77 65.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.102 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.7 t -60.08 -31.36 69.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.884 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -85.81 -29.98 23.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.199 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.944 ' CD2' HG21 ' A' ' 39' ' ' VAL . 1.5 t80 -60.25 -47.18 87.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.915 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.404 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 14.8 p -58.09 -50.08 74.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.82 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -21.63 9.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.107 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.3 tttm -88.44 -59.37 2.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.833 0.349 . . . . 0.0 110.961 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.8 mtt -90.27 -56.35 3.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.489 -179.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . 0.452 ' CZ2' ' CB ' ' A' ' 14' ' ' LEU . 28.4 t90 -53.94 -24.75 17.49 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.71 0.263 . . . . 0.0 111.71 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.32 -48.32 6.21 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.567 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.93 -28.2 39.75 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.53 ' HB3' ' HD3' ' A' ' 71' ' ' LYS . . . -105.02 151.23 24.21 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.785 0.326 . . . . 0.0 110.814 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.1 mmtt -95.37 92.95 6.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.878 -179.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.593 ' HB2' ' O ' ' A' ' 93' ' ' TYR . 0.0 OUTLIER -142.77 96.97 3.02 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.845 178.692 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.666 ' O ' HG23 ' A' ' 72' ' ' ILE . 0.5 OUTLIER -141.58 103.07 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.076 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.571 ' CB ' ' HB2' ' A' ' 93' ' ' TYR . 0.0 OUTLIER -166.81 178.65 5.75 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.664 -0.414 . . . . 0.0 111.263 177.862 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 90' ' ' ALA . 11.7 p -123.45 153.02 28.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.889 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -99.52 -118.38 0.15 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.588 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 54.8 p90 -107.07 134.15 50.63 Favored 'General case' 0 N--CA 1.457 -0.085 0 CA-C-O 120.798 0.332 . . . . 0.0 111.039 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 30.7 p-10 -78.7 117.95 20.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.942 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.25 -34.0 19.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.996 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 57.64 28.78 60.37 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.492 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -91.97 -64.05 1.16 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.718 0.294 . . . . 0.0 110.9 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -54.81 42.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.826 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.425 HG23 ' O ' ' A' ' 82' ' ' THR . 11.9 t -70.72 120.86 16.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.622 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -115.38 -51.27 2.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.971 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 3.7 pttm -101.41 -29.34 12.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.898 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.14 -35.65 76.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.54 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 67.7 24.19 74.04 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.684 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.427 ' HA ' ' CE2' ' A' ' 34' ' ' PHE . 0.6 OUTLIER -121.32 97.95 5.75 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.26 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -61.71 115.88 8.57 Favored Glycine 0 N--CA 1.452 -0.296 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 178.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.481 ' O ' HD22 ' A' ' 36' ' ' LEU . 1.5 mt -77.25 97.3 4.79 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.151 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.487 ' O ' HG23 ' A' ' 74' ' ' VAL . . . -174.17 114.24 0.19 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.116 177.722 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.676 ' OH ' HD11 ' A' ' 25' ' ' LEU . 0.3 OUTLIER -145.21 94.35 2.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.476 179.156 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 6.6 pt -150.17 108.86 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 C-N-CA 120.409 -0.516 . . . . 0.0 111.953 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.593 ' O ' ' HB2' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -151.65 168.78 23.91 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.387 179.294 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -122.07 106.48 11.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.833 0.349 . . . . 0.0 111.233 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.4 t0 52.07 26.21 3.66 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.835 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 77.8 13.88 82.97 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.57 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.5 mtpm? -136.96 149.22 47.42 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.735 0.302 . . . . 0.0 110.873 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 1.3 ttt -82.71 110.37 17.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.925 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.419 ' O ' HG12 ' A' ' 99' ' ' VAL . 31.4 t 59.5 62.28 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.102 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 57.11 -168.17 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.064 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -97.98 -46.47 5.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.05 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -106.2 139.21 41.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.077 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -123.82 -68.42 0.87 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.988 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.2 t 58.99 103.92 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.08 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 22.8 ptt180 -152.14 -43.86 0.11 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.928 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -168.35 35.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.976 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -115.84 -129.98 4.59 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.422 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.9 mp -76.69 -21.1 55.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.63 0.253 . . . . 0.0 110.953 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 66.49 98.14 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.889 0.376 . . . . 0.0 111.075 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.186 -0.911 . . . . 0.0 110.851 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.854 0.359 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 18.2 p -125.68 138.02 53.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.868 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -111.99 143.78 42.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.943 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.9 p -111.95 154.07 25.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.948 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -55.1 148.05 14.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.109 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -115.28 106.8 14.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.858 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.408 HD13 ' C ' ' A' ' 75' ' ' GLU . 1.7 pp -69.96 156.9 38.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.146 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 12.9 t60 -90.49 159.1 16.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.704 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.52 120.41 42.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.915 0.388 . . . . 0.0 111.356 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.826 ' O ' HG23 ' A' ' 74' ' ' VAL . 12.5 mt-10 -137.83 129.02 15.98 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.336 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.757 ' HA ' ' HA ' ' A' ' 73' ' ' GLU . 87.7 Cg_endo -82.76 158.84 16.24 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.42 2.08 . . . . 0.0 112.939 -179.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.933 ' HB2' HD12 ' A' ' 25' ' ' LEU . . . -115.84 -129.87 0.3 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.56 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.645 HG23 ' O ' ' A' ' 12' ' ' ALA . 0.1 OUTLIER 175.99 -86.74 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.218 0 O-C-N 122.269 -0.27 . . . . 0.0 111.698 179.784 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.37 112.39 23.97 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.852 0.358 . . . . 0.0 111.234 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.807 HD11 HG21 ' A' ' 72' ' ' ILE . 2.6 mp -125.47 160.21 31.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.241 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.637 ' O ' HG12 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -115.19 122.8 47.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.374 179.439 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.405 ' HA ' HG12 ' A' ' 23' ' ' VAL . . . -112.29 123.61 50.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.447 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.636 HG23 ' H ' ' A' ' 19' ' ' ASP . 0.5 OUTLIER -117.87 -89.43 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.812 179.755 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.636 ' H ' HG23 ' A' ' 18' ' ' ILE . 1.0 OUTLIER -118.32 28.84 8.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.716 0.294 . . . . 0.0 110.977 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.551 ' HA3' HD23 ' A' ' 36' ' ' LEU . . . 61.32 57.42 18.34 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.233 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -147.19 -44.26 0.17 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.805 0.336 . . . . 0.0 110.795 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 54.6 p -132.51 106.87 8.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.182 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.637 HG12 ' O ' ' A' ' 16' ' ' LYS . 27.5 m -128.76 113.71 30.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.52 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.537 ' HB3' HG23 ' A' ' 33' ' ' THR . 12.6 ptmt -90.35 105.54 17.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.681 -179.257 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.933 HD12 ' HB2' ' A' ' 12' ' ' ALA . 1.7 pt? -108.1 165.05 11.77 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.347 179.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 2.7 ttm -77.37 99.85 5.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.857 0.361 . . . . 0.0 111.047 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.407 ' CE2' HG21 ' A' ' 74' ' ' VAL . 36.6 t80 -115.0 100.33 8.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.744 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 61.16 31.04 19.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.896 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.39 24.28 66.04 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.774 -0.726 . . . . 0.0 112.549 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -142.1 120.89 7.74 Favored Pre-proline 0 C--N 1.33 -0.257 0 O-C-N 122.769 -0.254 . . . . 0.0 110.981 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -59.72 132.41 45.3 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.353 2.035 . . . . 0.0 112.002 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 11.7 mtp -134.49 118.06 16.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.978 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.537 HG23 ' HB3' ' A' ' 24' ' ' LYS . 0.8 OUTLIER -95.59 127.21 41.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.102 -179.906 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.59 ' HE1' HD22 ' A' ' 25' ' ' LEU . 35.2 p90 -141.03 158.18 44.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.985 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -92.74 148.14 22.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.774 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.551 HD23 ' HA3' ' A' ' 20' ' ' GLY . 4.7 pp -48.98 153.95 0.81 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.297 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.765 ' HB3' ' HB3' ' A' ' 90' ' ' ALA . 0.5 OUTLIER -66.96 155.05 39.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.093 -179.878 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.447 HD23 ' H ' ' A' ' 38' ' ' LEU . 0.7 OUTLIER -113.02 131.58 55.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.818 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.8 m -84.86 137.83 20.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.195 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -95.12 123.41 38.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.905 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.454 HG23 ' HD2' ' A' ' 42' ' ' PRO . 71.5 m -88.35 139.44 30.16 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.826 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.454 ' HD2' HG23 ' A' ' 41' ' ' THR . 39.8 Cg_endo -67.19 148.75 81.2 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.471 2.114 . . . . 0.0 112.169 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -69.64 -28.59 66.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.027 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.7 m -75.06 147.68 40.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.105 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 4.0 mtpm? 63.14 -80.17 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.208 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.441 ' CG ' ' HD2' ' A' ' 47' ' ' PRO . 1.8 t-80 -91.39 148.4 37.51 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.944 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.441 ' HD2' ' CG ' ' A' ' 46' ' ' HIS . 48.5 Cg_exo -55.71 153.44 30.12 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.528 2.152 . . . . 0.0 112.236 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.4 tttp -92.74 107.78 19.48 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.805 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.72 130.37 4.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.853 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.99 86.19 0.38 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.447 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 27.5 m -71.05 161.56 4.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.726 0.298 . . . . 0.0 111.138 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.507 ' OE2' HD11 ' A' ' 36' ' ' LEU . 0.1 OUTLIER -108.01 151.69 25.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.848 -179.997 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 6.5 mtpm? -59.68 95.88 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.898 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.4 p90 -96.75 27.6 3.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.03 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -113.98 166.68 12.17 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.589 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.43 -18.9 29.3 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.656 2.237 . . . . 0.0 112.569 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -52.53 -25.71 11.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.32 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.03 -60.77 3.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.412 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 94.8 p -92.93 -16.04 25.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.538 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -83.84 -61.76 1.74 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.716 0.293 . . . . 0.0 111.451 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -54.78 -53.87 49.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.259 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.522 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 36.9 p -59.7 -21.05 60.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.233 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.403 ' HA ' ' HB2' ' A' ' 67' ' ' GLU . 11.5 tttt -89.11 -19.48 25.49 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.334 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp -88.59 -64.18 1.18 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.857 -179.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -89.14 -54.31 4.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.685 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . 0.522 ' HB3' ' O ' ' A' ' 62' ' ' THR . 37.8 t90 -58.75 -18.55 32.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.713 -179.281 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.403 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -90.81 -44.6 9.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.826 0.346 . . . . 0.0 111.192 -179.935 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -79.99 -28.04 39.56 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.184 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -108.04 151.21 26.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.86 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.2 ptpt -100.83 92.6 5.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.407 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.416 ' HG3' ' HA ' ' A' ' 94' ' ' ALA . 0.0 OUTLIER -138.26 98.03 3.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.052 179.423 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.807 HG21 HD11 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -139.86 119.88 13.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.771 0.319 . . . . 0.0 111.596 -179.545 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.757 ' HA ' ' HA ' ' A' ' 11' ' ' PRO . 10.4 mt-10 -149.25 172.11 15.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.479 179.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.826 HG23 ' O ' ' A' ' 10' ' ' GLU . 34.9 t -100.85 141.57 17.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.4 -179.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.408 ' C ' HD13 ' A' ' 7' ' ' LEU . 0.9 OUTLIER -135.14 -2.86 2.5 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -179.744 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.467 ' CD1' ' HB3' ' A' ' 91' ' ' TYR . 0.0 OUTLIER -92.68 164.32 13.43 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.884 0.373 . . . . 0.0 111.573 -179.634 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.406 ' CB ' ' HB3' ' A' ' 7' ' ' LEU . 3.1 t70 -100.85 139.19 36.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.911 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.0 pttp -68.77 108.44 3.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.954 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 88.08 41.11 6.35 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.481 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.12 -63.69 1.36 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.785 0.326 . . . . 0.0 110.816 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -162.12 94.82 0.93 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.007 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.449 ' HB ' ' HA2' ' A' ' 86' ' ' GLY . 7.6 p -74.37 154.31 38.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.769 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -115.23 -51.8 2.7 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.293 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.6 tptt -110.74 -64.0 1.33 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.788 0.328 . . . . 0.0 111.612 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.415 ' O ' ' CG ' ' A' ' 85' ' ' TYR . 81.9 t80 -133.9 11.15 3.96 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.623 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.449 ' HA2' ' HB ' ' A' ' 82' ' ' THR . . . 128.09 -15.33 6.18 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.573 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -90.3 98.76 11.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.781 0.324 . . . . 0.0 110.929 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -147.11 -44.54 0.03 OUTLIER Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.438 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.41 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 4.3 mm? -81.5 148.36 29.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.897 0.38 . . . . 0.0 110.904 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.765 ' HB3' ' HB3' ' A' ' 37' ' ' LEU . . . -102.67 142.56 33.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.206 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.718 ' HB2' HG13 ' A' ' 74' ' ' VAL . 1.8 p90 -141.04 88.01 2.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.012 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -150.2 141.2 16.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.081 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.442 ' CD1' ' HG3' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -123.36 117.99 26.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.619 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.416 ' HA ' ' HG3' ' A' ' 71' ' ' LYS . . . -111.43 91.87 3.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.051 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 58.2 23.81 10.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.065 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -74.56 -100.96 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.551 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? -107.7 109.83 21.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.903 0.382 . . . . 0.0 110.887 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 7.9 mtp -78.43 131.09 36.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.885 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 9.7 m -74.67 128.07 36.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.113 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -71.8 82.6 0.89 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.908 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -135.82 142.86 44.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.83 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -82.05 -67.74 0.76 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.119 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.527 HD13 ' OXT' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -149.79 -78.29 0.14 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.899 179.896 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.4 t 57.2 90.07 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.214 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -137.44 -58.53 0.69 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.877 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -116.22 -41.44 3.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.857 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -173.47 -97.46 0.11 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.435 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -130.94 31.92 4.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.773 0.32 . . . . 0.0 110.854 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -125.4 148.74 48.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.082 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.527 ' OXT' HD13 ' A' ' 103' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.285 -0.865 . . . . 0.0 110.8 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.698 0.285 . . . . 0.0 111.023 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.02 107.98 18.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.908 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 63.8 p -107.22 110.19 22.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.959 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 40.9 p -76.75 123.86 26.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.824 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.19 108.63 19.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.918 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 tppm? -104.13 100.97 10.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.81 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.833 HD13 ' N ' ' A' ' 8' ' ' HIS . 0.7 OUTLIER -96.2 146.62 24.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.92 -179.883 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.833 ' N ' HD13 ' A' ' 7' ' ' LEU . 2.1 m-70 -114.03 109.77 18.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.912 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.787 ' CB ' HG23 ' A' ' 74' ' ' VAL . 1.0 OUTLIER -122.04 159.09 27.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.154 -179.852 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -104.09 164.27 15.66 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.627 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.447 ' CA ' ' HG3' ' A' ' 73' ' ' GLU . 91.0 Cg_endo -78.48 150.07 24.7 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.596 2.197 . . . . 0.0 112.692 -179.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.726 ' HB1' ' O ' ' A' ' 26' ' ' MET . . . -121.34 -81.86 0.64 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.194 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.67 HG23 ' O ' ' A' ' 12' ' ' ALA . 0.1 OUTLIER 171.36 131.25 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.725 0.298 . . . . 0.0 111.001 -179.984 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.742 HD13 ' N ' ' A' ' 15' ' ' ILE . 0.3 OUTLIER -98.19 130.29 44.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.994 179.716 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.742 ' N ' HD13 ' A' ' 14' ' ' LEU . 0.8 OUTLIER -84.46 -51.52 13.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.231 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.421 ' H ' HG13 ' A' ' 15' ' ' ILE . 14.2 tttm -164.46 151.26 11.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.518 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.687 ' HA ' HG12 ' A' ' 23' ' ' VAL . . . -125.43 148.05 48.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.406 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.9 pt -123.82 -167.0 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.914 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -71.19 62.7 0.33 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.796 0.332 . . . . 0.0 111.431 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.427 ' HA3' ' CD2' ' A' ' 36' ' ' LEU . . . 44.33 77.22 0.1 OUTLIER Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.989 -0.625 . . . . 0.0 113.095 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -147.64 -46.26 0.17 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.98 0.419 . . . . 0.0 110.796 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -167.99 106.93 0.52 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.873 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.776 HG22 ' O ' ' A' ' 34' ' ' PHE . 32.6 m -121.35 113.85 41.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.672 179.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.4 ' O ' HG13 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -87.66 147.4 25.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.358 -179.548 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.768 HD21 ' CD2' ' A' ' 34' ' ' PHE . 0.1 OUTLIER -137.99 137.21 37.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.176 179.622 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.726 ' O ' ' HB1' ' A' ' 12' ' ' ALA . 3.1 tpt -72.75 99.43 2.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.923 0.392 . . . . 0.0 110.863 -179.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -118.78 116.22 26.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.702 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 25.4 mmtm 58.86 28.09 17.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.89 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.12 25.5 66.28 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.553 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -142.07 113.07 6.28 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 120.453 0.168 . . . . 0.0 110.901 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.83 141.0 95.9 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.477 2.118 . . . . 0.0 112.271 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.439 ' HB3' ' CZ ' ' A' ' 34' ' ' PHE . 0.6 OUTLIER -142.2 110.92 6.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.979 -179.848 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.422 ' O ' ' CD1' ' A' ' 34' ' ' PHE . 1.4 t -78.28 139.9 38.86 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.196 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.776 ' O ' HG22 ' A' ' 23' ' ' VAL . 26.0 m-85 -141.39 138.51 33.04 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.194 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -101.11 148.07 25.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.641 179.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.447 ' O ' HD12 ' A' ' 36' ' ' LEU . 0.3 OUTLIER -56.57 169.3 0.48 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.34 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.685 ' H ' HD13 ' A' ' 37' ' ' LEU . 0.0 OUTLIER -95.73 163.06 13.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.932 179.832 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.41 96.88 7.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.772 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.488 ' O ' HG13 ' A' ' 39' ' ' VAL . 14.3 p -108.6 121.45 61.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.168 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -122.71 145.14 48.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.846 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.8 t -102.04 116.23 63.5 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.924 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -67.59 161.28 44.24 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.436 2.091 . . . . 0.0 112.173 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.58 -82.54 0.05 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.82 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -111.14 100.95 9.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.94 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -177.9 -78.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.92 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -112.73 163.84 16.9 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.946 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -53.04 148.81 29.11 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.556 2.171 . . . . 0.0 112.299 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -78.64 142.41 37.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.963 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 2.7 pttp -168.25 -43.5 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.943 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -60.85 169.84 8.5 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.539 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.501 HG22 ' N ' ' A' ' 52' ' ' GLU . 11.3 p -102.95 159.31 4.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.79 0.329 . . . . 0.0 111.059 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.501 ' N ' HG22 ' A' ' 51' ' ' VAL . 1.6 mp0 -92.85 149.97 20.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.808 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.91 90.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.894 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -112.59 -33.91 5.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.915 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 136.27 -147.97 19.46 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.445 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -69.2 -9.97 27.74 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.584 2.189 . . . . 0.0 112.6 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.81 -29.69 55.25 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.746 0.308 . . . . 0.0 110.997 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.24 -31.01 68.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.046 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 t -71.59 -24.12 61.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.063 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -55.5 -23.24 24.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.371 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -53.38 -52.06 60.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.085 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.405 ' O ' ' N ' ' A' ' 66' ' ' TRP . 1.3 p -60.98 -47.86 84.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.966 0.412 . . . . 0.0 110.914 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.2 mtmt -55.7 -20.03 12.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.358 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.4 tptt -84.98 -59.8 2.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.722 0.296 . . . . 0.0 111.37 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 14.0 mtt -90.01 -49.9 6.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.313 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . 0.862 ' CE2' HG22 ' A' ' 72' ' ' ILE . 10.0 t-105 -54.79 -34.72 63.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.303 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -94.49 -52.13 4.46 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -79.79 -28.38 40.3 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.353 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.637 ' HB3' ' HD3' ' A' ' 71' ' ' LYS . . . -107.22 151.16 25.8 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.839 0.352 . . . . 0.0 111.224 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.4 tttt -89.69 92.99 9.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.568 -179.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.637 ' HD3' ' HB3' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -166.22 98.33 0.61 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.556 179.096 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.862 HG22 ' CE2' ' A' ' 66' ' ' TRP . 4.8 pt -139.9 128.79 27.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.0 0.428 . . . . 0.0 111.828 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.447 ' HG3' ' CA ' ' A' ' 11' ' ' PRO . 0.2 OUTLIER -162.42 171.02 17.81 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.032 179.605 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.787 HG23 ' CB ' ' A' ' 9' ' ' LYS . 0.4 OUTLIER -111.28 152.99 13.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.809 179.699 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -93.51 -79.66 0.4 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.521 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.42 ' O ' ' CE1' ' A' ' 91' ' ' TYR . 7.0 p90 -129.73 141.44 50.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.807 0.337 . . . . 0.0 111.324 -179.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -104.05 110.38 22.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.748 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.421 ' HB2' HD21 ' A' ' 89' ' ' LEU . 1.6 tttt -58.83 -35.23 72.57 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.903 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 106.16 28.04 5.38 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.431 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -106.97 161.7 14.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.79 0.329 . . . . 0.0 110.839 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.77 45.15 2.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.883 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 1.8 p -95.88 126.49 41.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.945 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -115.12 -50.85 2.74 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.948 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -104.64 -21.67 13.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.139 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -55.45 -30.64 60.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.235 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 125.19 51.35 0.18 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.535 -0.841 . . . . 0.0 112.554 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.584 ' NE ' HD12 ' A' ' 89' ' ' LEU . 1.7 ttt85 -58.75 112.85 1.78 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.883 0.373 . . . . 0.0 110.959 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -105.32 22.07 33.72 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.779 -0.725 . . . . 0.0 112.561 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.584 HD12 ' NE ' ' A' ' 87' ' ' ARG . 38.2 mt -78.06 148.02 34.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.715 0.293 . . . . 0.0 110.695 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -105.95 134.29 49.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.033 0.444 . . . . 0.0 111.502 -179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.756 ' HB3' HG12 ' A' ' 74' ' ' VAL . 96.9 m-85 -142.12 90.22 2.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.456 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.623 HD13 ' O ' ' A' ' 91' ' ' TYR . 25.3 mm -133.82 116.89 24.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.983 0.421 . . . . 0.0 111.818 -179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.44 ' HB3' ' HB3' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -151.13 117.78 5.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.326 179.219 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.512 ' HB1' ' HG3' ' A' ' 71' ' ' LYS . . . -94.38 113.36 25.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.679 -179.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.512 ' N ' ' HB2' ' A' ' 71' ' ' LYS . 16.3 t70 49.97 25.91 1.82 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.985 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 59.14 102.69 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.237 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.3 mtpt -87.03 99.74 12.12 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.987 0.422 . . . . 0.0 110.781 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -82.16 141.74 32.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.786 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 12.0 p -104.19 -30.82 2.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.045 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -127.51 -72.16 0.64 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.998 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -176.8 -177.46 0.79 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.936 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -109.83 157.7 18.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.181 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 5.5 mt -93.57 -175.06 3.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.869 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 30.9 m -56.25 155.59 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.22 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.25 -62.19 1.56 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.929 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -158.4 32.48 0.24 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.029 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 139.36 -100.13 0.28 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.6 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.736 HD13 ' N ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -118.5 73.81 0.93 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.843 0.354 . . . . 0.0 110.98 -179.877 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -57.82 -42.1 83.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.141 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 5.7 mtmt . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.131 -0.938 . . . . 0.0 111.002 179.883 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.778 0.323 . . . . 0.0 111.041 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 55.5 p -102.65 99.27 9.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.863 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.9 p -87.39 134.68 33.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.924 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.11 109.41 1.83 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.917 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -79.96 113.22 17.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.908 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.19 143.8 32.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.811 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.97 141.17 34.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.865 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -93.63 159.07 15.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.846 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.4 mttp -75.86 107.9 8.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.021 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.771 ' O ' HG12 ' A' ' 74' ' ' VAL . 2.4 mt-10 -139.13 143.54 37.11 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.521 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.522 ' HA ' ' HA ' ' A' ' 73' ' ' GLU . 84.2 Cg_endo -83.75 164.37 13.98 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.476 2.117 . . . . 0.0 112.711 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.816 ' HB1' HD22 ' A' ' 25' ' ' LEU . . . -119.29 104.69 10.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.999 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 44.7 p -64.69 80.94 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.273 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.745 HD22 ' HB ' ' A' ' 62' ' ' THR . 3.2 tt -69.7 120.96 16.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.431 179.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 26.4 mt -125.27 -69.86 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.863 ' O ' HG13 ' A' ' 23' ' ' VAL . 3.7 pttt -121.68 145.95 47.5 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.925 0.393 . . . . 0.0 111.435 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.761 ' HB2' HG22 ' A' ' 23' ' ' VAL . . . -124.08 147.52 47.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.868 179.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.6 mm -96.81 -88.92 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.346 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -118.25 107.32 13.77 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.8 0.333 . . . . 0.0 111.045 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 98.67 -113.99 4.89 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.447 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -123.25 16.39 9.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.599 0.237 . . . . 0.0 111.159 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.6 t -74.85 106.78 6.55 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.893 0.378 . . . . 0.0 110.725 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.863 HG13 ' O ' ' A' ' 16' ' ' LYS . 16.8 t -128.77 134.67 63.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.966 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.523 ' CD ' HG23 ' A' ' 33' ' ' THR . 0.0 OUTLIER -79.73 97.86 6.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.707 -179.928 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.816 HD22 ' HB1' ' A' ' 12' ' ' ALA . 0.2 OUTLIER -99.38 142.53 30.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.867 -179.769 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.76 100.0 3.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.915 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -96.73 100.42 11.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.873 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.9 tttm 56.31 31.35 18.43 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.988 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 90.54 20.92 39.12 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.823 -0.704 . . . . 0.0 112.576 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.89 112.5 6.88 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.572 0.225 . . . . 0.0 110.778 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.2 129.49 21.8 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.351 2.034 . . . . 0.0 112.358 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 34' ' ' PHE . 33.6 mmm -145.04 118.7 9.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.933 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.523 HG23 ' CD ' ' A' ' 24' ' ' LYS . 0.8 OUTLIER -70.38 135.34 48.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.077 -179.966 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.726 ' HB3' ' HB3' ' A' ' 90' ' ' ALA . 27.0 m-85 -140.69 152.75 45.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.907 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.0 mtt-85 -117.3 148.0 42.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.972 0.415 . . . . 0.0 111.081 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.653 HD12 ' HB3' ' A' ' 91' ' ' TYR . 35.0 tp -78.06 138.39 38.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.786 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.71 HD23 ' O ' ' A' ' 37' ' ' LEU . 8.5 tt -82.83 94.34 7.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.804 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.421 HD23 ' HG ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -124.88 163.33 22.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.909 -179.978 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.49 HG21 ' HB3' ' A' ' 49' ' ' LYS . 21.3 m -61.95 159.92 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.241 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -128.28 132.08 48.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.614 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.7 t -76.93 111.34 15.7 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.064 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -67.93 163.04 37.17 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.541 2.16 . . . . 0.0 112.191 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -98.27 37.87 1.4 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.802 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 69.0 p -103.71 103.84 13.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.041 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.2 mtpm? 62.04 -82.8 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.081 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -120.94 146.64 44.38 Favored Pre-proline 0 C--N 1.332 -0.185 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.07 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -74.43 125.89 9.95 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.619 2.212 . . . . 0.0 112.219 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.8 tttp -124.91 112.97 17.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.996 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.49 ' HB3' HG21 ' A' ' 39' ' ' VAL . 0.1 OUTLIER 61.57 118.05 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.924 179.891 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 158.65 127.4 0.92 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.505 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 28.8 t -110.23 106.11 20.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.847 0.356 . . . . 0.0 110.973 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -92.94 179.3 5.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.974 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.53 90.97 0.05 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.793 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -89.66 -32.89 16.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.955 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 155.42 -152.34 23.84 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.667 -0.777 . . . . 0.0 112.603 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -59.9 -16.41 38.22 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.745 2.297 . . . . 0.0 112.699 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -46.55 -29.19 1.68 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.429 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -77.46 -53.47 7.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.18 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.88 ' O ' HG22 ' A' ' 62' ' ' THR . 20.7 p -69.52 -24.54 63.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.238 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -54.72 -23.51 18.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.613 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -55.1 -31.11 60.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.815 0.34 . . . . 0.0 111.198 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.88 HG22 ' O ' ' A' ' 59' ' ' SER . 13.0 t -79.07 -17.48 55.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.279 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 67' ' ' GLU . 0.5 OUTLIER -89.41 -57.28 2.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.847 0.356 . . . . 0.0 111.441 -179.73 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.0 mtmp? -88.65 -59.18 2.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.205 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.847 ' HA ' ' HB3' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -55.67 -20.36 13.86 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.664 -179.347 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . 0.447 ' CE2' ' CG ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -99.22 -33.71 10.65 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.359 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.413 ' HB2' ' O ' ' A' ' 63' ' ' LYS . 5.2 mt-10 -94.0 -56.32 2.91 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 -179.534 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -80.17 -28.87 38.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.892 0.377 . . . . 0.0 110.991 -179.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.847 ' HB3' ' HA ' ' A' ' 65' ' ' MET . . . -108.78 152.6 24.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.698 179.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.401 ' HG2' ' HB3' ' A' ' 95' ' ' ASP . 0.0 OUTLIER -52.48 163.74 0.4 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.46 -179.754 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.447 ' CG ' ' CE2' ' A' ' 66' ' ' TRP . 0.1 OUTLIER -84.9 162.06 19.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.108 0.48 . . . . 0.0 111.486 -178.622 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.959 HD13 HG22 ' A' ' 92' ' ' ILE . 1.1 pp -102.83 145.22 12.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.849 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.522 ' HA ' ' HA ' ' A' ' 11' ' ' PRO . 44.5 mt-10 -127.89 179.1 5.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.634 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.771 HG12 ' O ' ' A' ' 10' ' ' GLU . 10.6 p -112.34 140.97 29.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.907 0.384 . . . . 0.0 111.055 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -106.88 -66.89 0.98 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.02 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 35.8 p90 -143.0 129.35 19.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.947 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.53 157.84 15.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.993 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -49.56 77.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.811 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 64.0 32.28 83.65 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.591 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -101.57 9.39 41.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.614 0.245 . . . . 0.0 111.315 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 26.4 mtm180 54.57 95.43 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.714 0.292 . . . . 0.0 111.175 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 41.7 m -62.2 148.98 42.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.908 0.385 . . . . 0.0 110.664 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -115.29 -40.18 3.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.287 -179.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.41 -63.11 1.02 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.245 -179.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -127.36 -35.15 2.21 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.15 -179.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 109.56 49.8 0.73 Allowed Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.728 -0.749 . . . . 0.0 111.845 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.403 ' HB2' ' CZ ' ' A' ' 87' ' ' ARG . 2.5 mtm105 -131.92 101.77 5.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.782 0.325 . . . . 0.0 111.022 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -48.83 171.44 0.07 OUTLIER Glycine 0 CA--C 1.518 0.26 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.415 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.4 mp -111.19 112.66 24.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.84 0.352 . . . . 0.0 111.192 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.726 ' HB3' ' HB3' ' A' ' 34' ' ' PHE . . . -128.62 130.08 46.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.798 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.653 ' HB3' HD12 ' A' ' 36' ' ' LEU . 0.0 OUTLIER -98.85 149.82 22.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.066 -179.762 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.959 HG22 HD13 ' A' ' 72' ' ' ILE . 2.7 pp -79.88 160.12 4.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.056 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.589 ' O ' HG22 ' A' ' 72' ' ' ILE . 5.8 m-85 -140.85 168.23 20.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.947 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.84 112.52 24.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.996 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.401 ' HB3' ' HG2' ' A' ' 70' ' ' LYS . 3.9 p30 45.21 41.93 6.46 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.412 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 104.69 -60.01 0.43 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.657 -0.783 . . . . 0.0 112.673 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.08 142.67 51.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.862 0.363 . . . . 0.0 110.966 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -60.09 140.37 56.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.026 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.48 HG12 ' N ' ' A' ' 100' ' ' ASN . 5.4 t -80.34 163.1 3.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.959 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.48 ' N ' HG12 ' A' ' 99' ' ' VAL . 29.1 p30 -47.27 164.18 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.181 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -57.73 136.91 56.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.998 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.417 ' HB2' HD13 ' A' ' 108' ' ' LEU . . . 62.05 115.89 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.264 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.522 HD22 HG13 ' A' ' 104' ' ' VAL . 1.4 tt -132.45 -66.78 0.68 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.899 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.522 HG13 HD22 ' A' ' 103' ' ' LEU . 13.0 m -144.66 30.9 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.028 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.06 -172.81 3.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.852 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 6.8 pm0 -109.89 29.05 7.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.074 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 136.45 63.09 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.739 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.516 ' N ' HD22 ' A' ' 108' ' ' LEU . 3.3 mm? 54.62 86.9 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.876 0.369 . . . . 0.0 111.173 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 63.29 -80.81 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.178 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.132 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.829 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.422 0 CA-C-O 120.717 0.294 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.4 t -107.19 95.31 5.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.805 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.8 m -74.45 128.84 36.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.958 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 76.9 p -68.18 104.01 1.7 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.904 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.72 157.03 21.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.897 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.6 tptt -69.01 137.48 53.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.956 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.601 HD11 ' HE2' ' A' ' 27' ' ' TYR . 0.5 OUTLIER -76.4 120.26 21.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.005 179.98 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.414 ' CE1' ' OH ' ' A' ' 27' ' ' TYR . 12.8 p-80 -70.99 157.19 38.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.703 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.6 mmtp -94.98 112.65 24.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.423 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.0 113.75 32.67 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.246 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.43 ' HA ' ' O ' ' A' ' 72' ' ' ILE . 83.1 Cg_endo -86.65 109.31 0.85 Allowed 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.513 2.142 . . . . 0.0 113.223 -178.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -166.42 -78.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.556 179.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.636 HG22 ' HB2' ' A' ' 25' ' ' LEU . 30.1 p 41.88 28.74 0.1 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 179.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.459 ' O ' HD13 ' A' ' 15' ' ' ILE . 1.0 OUTLIER -98.16 85.55 3.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.857 0.36 . . . . 0.0 110.563 179.411 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.475 HG21 ' HG2' ' A' ' 24' ' ' LYS . 10.5 mm -126.29 -69.81 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.88 179.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -141.85 173.04 11.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.304 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -122.35 140.0 53.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.034 0.445 . . . . 0.0 111.554 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.857 HG22 HG12 ' A' ' 23' ' ' VAL . 7.8 tt -173.6 164.23 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.768 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.42 171.97 5.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.784 0.326 . . . . 0.0 110.872 -179.656 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -60.86 82.98 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.617 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -147.27 -49.66 0.18 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.083 0.468 . . . . 0.0 110.47 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 t -172.06 106.58 0.2 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.515 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.857 HG12 HG22 ' A' ' 18' ' ' ILE . 35.9 m -122.52 127.59 75.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.122 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.475 ' HG2' HG21 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -79.21 133.99 36.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.864 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.649 HD23 ' O ' ' A' ' 32' ' ' MET . 0.5 OUTLIER -126.29 148.08 49.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.632 179.975 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.74 101.81 3.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.054 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.601 ' HE2' HD11 ' A' ' 7' ' ' LEU . 3.0 t80 -119.81 120.53 36.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.745 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.3 pttt 49.09 28.11 1.98 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.341 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.65 10.36 85.91 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.82 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.429 ' HA ' ' HD3' ' A' ' 31' ' ' PRO . 1.7 mm-40 -121.97 142.46 36.44 Favored Pre-proline 0 CA--C 1.53 0.197 0 CA-C-N 116.726 0.263 . . . . 0.0 110.888 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 30' ' ' GLN . 35.0 Cg_exo -59.87 127.56 23.83 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.493 2.129 . . . . 0.0 112.264 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.649 ' O ' HD23 ' A' ' 25' ' ' LEU . 25.6 mmt -145.21 110.75 5.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.782 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' A' ' 23' ' ' VAL . 1.6 t -101.41 86.93 3.08 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.878 0.37 . . . . 0.0 111.829 -179.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.65 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.4 OUTLIER -113.48 107.65 16.11 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.961 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.818 ' HA ' ' O ' ' A' ' 90' ' ' ALA . 16.5 tpt180 -143.88 95.01 2.66 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.202 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.927 HD22 HD23 ' A' ' 89' ' ' LEU . 0.1 OUTLIER -145.39 88.42 1.86 Allowed 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.386 178.551 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.66 HD12 HG13 ' A' ' 39' ' ' VAL . 3.2 pp -110.02 126.35 53.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.003 0.43 . . . . 0.0 110.754 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -44.33 122.78 3.16 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.641 -179.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.66 HG13 HD12 ' A' ' 37' ' ' LEU . 9.5 m -141.98 109.81 2.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.849 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.845 ' O ' HG22 ' A' ' 51' ' ' VAL . 4.9 p30 -125.32 95.73 4.57 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.046 -179.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.796 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -126.16 147.32 59.1 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.886 179.966 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.796 ' HD2' HG22 ' A' ' 41' ' ' THR . 57.3 Cg_exo -51.64 131.34 37.02 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.606 2.204 . . . . 0.0 112.36 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -141.06 -174.3 3.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.868 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 50.7 p -78.19 151.09 33.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.863 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.9 mmtt 65.7 -78.43 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.838 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 10.2 m170 -72.8 112.6 15.88 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.928 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.78 120.97 6.03 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.376 2.051 . . . . 0.0 112.377 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.9 160.62 31.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.85 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -170.98 44.06 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.925 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -84.34 -72.96 1.27 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.447 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.845 HG22 ' O ' ' A' ' 40' ' ' ASP . 9.9 m -75.87 170.09 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.736 0.303 . . . . 0.0 111.134 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -91.7 154.91 18.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.818 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.86 90.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.836 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -102.34 -31.5 10.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.94 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 77.43 -139.67 23.45 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.534 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -68.96 -10.23 28.58 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.571 2.181 . . . . 0.0 112.527 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -54.9 -34.47 63.12 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.796 0.332 . . . . 0.0 111.035 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.55 -49.93 75.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.106 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.7 t -77.73 -16.02 58.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.406 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -50.89 -29.52 12.17 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.827 0.346 . . . . 0.0 111.5 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.52 ' HB3' HD11 ' A' ' 92' ' ' ILE . 4.7 m-85 -57.48 -34.82 69.43 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.867 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.539 ' O ' ' HB3' ' A' ' 66' ' ' TRP . 29.3 p -91.17 -15.29 29.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.215 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.428 ' O ' ' HB2' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -89.69 -56.96 3.04 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -179.264 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.8 tmtt? -89.18 -64.57 1.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.496 ' HA ' ' HB3' ' A' ' 69' ' ' ALA . 0.5 OUTLIER -59.43 -20.47 55.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.464 -178.311 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' TRP . . . . . 0.539 ' HB3' ' O ' ' A' ' 62' ' ' THR . 23.9 t90 -99.39 -33.83 10.54 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -179.067 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.428 ' HB2' ' O ' ' A' ' 63' ' ' LYS . 9.7 mm-40 -94.12 -53.57 3.91 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 -179.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -79.75 -28.32 40.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.654 0.264 . . . . 0.0 111.578 -178.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.496 ' HB3' ' HA ' ' A' ' 65' ' ' MET . . . -108.23 151.29 26.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.813 0.339 . . . . 0.0 111.23 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.1 mtmp? -97.94 94.83 7.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.274 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.511 ' HG3' ' HB1' ' A' ' 94' ' ' ALA . 0.0 OUTLIER -164.45 98.95 0.81 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.502 179.567 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.467 HG22 ' CD1' ' A' ' 66' ' ' TRP . 0.0 OUTLIER -133.48 127.48 53.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.12 179.864 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -162.87 158.26 22.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.735 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.604 HG11 HD13 ' A' ' 25' ' ' LEU . 7.3 m -133.54 152.52 35.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.145 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -157.54 93.55 1.3 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.864 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.56 ' CD1' ' HB2' ' A' ' 90' ' ' ALA . 42.0 p90 -143.13 118.11 10.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.155 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -91.91 91.9 8.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.606 179.683 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.482 ' HE3' HD13 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -94.52 -68.83 0.78 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.126 -179.719 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 64.13 27.31 71.27 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.352 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -129.18 116.05 18.61 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.977 0.418 . . . . 0.0 110.8 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.36 102.04 0.16 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.916 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.54 HG21 ' H ' ' A' ' 87' ' ' ARG . 26.7 m -58.77 149.12 27.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.44 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -115.74 -48.78 2.75 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -178.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.33 -63.17 0.58 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.309 -0.405 . . . . 0.0 112.049 -178.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -133.31 -35.33 1.03 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.788 0.328 . . . . 0.0 111.25 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.42 ' HA2' ' HB ' ' A' ' 82' ' ' THR . . . 120.55 34.61 0.92 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.816 -179.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.54 ' H ' HG21 ' A' ' 82' ' ' THR . 0.1 OUTLIER -138.89 120.38 15.02 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.104 0.478 . . . . 0.0 110.945 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -75.01 -140.16 0.7 Allowed Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 115.791 -0.64 . . . . 0.0 112.759 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.927 HD23 HD22 ' A' ' 36' ' ' LEU . 3.4 mp -128.46 116.01 19.05 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 122.109 0.163 . . . . 0.0 111.134 -179.409 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.818 ' O ' ' HA ' ' A' ' 35' ' ' ARG . . . -136.33 161.98 34.3 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 178.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.497 ' N ' ' CD1' ' A' ' 91' ' ' TYR . 0.0 OUTLIER -132.07 158.07 42.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.403 -178.874 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.52 HD11 ' HB3' ' A' ' 61' ' ' PHE . 2.4 pp -79.94 148.16 6.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.342 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -140.17 129.69 24.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.878 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.511 ' HB1' ' HG3' ' A' ' 71' ' ' LYS . . . -83.98 110.23 18.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.378 -179.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.501 ' N ' ' HB2' ' A' ' 71' ' ' LYS . 1.5 t70 60.72 20.22 10.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.685 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 64.66 122.92 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.518 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.7 tptm -93.58 107.06 18.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.759 0.314 . . . . 0.0 110.849 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.07 149.29 29.28 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.989 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.473 ' O ' HG23 ' A' ' 99' ' ' VAL . 18.0 m -142.99 69.9 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.094 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -99.19 161.75 13.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.902 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -129.06 30.95 4.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.948 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -125.29 83.18 2.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.155 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.453 ' N ' HD12 ' A' ' 103' ' ' LEU . 5.9 mp -102.83 125.73 49.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.889 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 104' ' ' VAL . 28.5 m -80.91 124.87 39.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.09 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.87 24.83 2.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.043 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 57.91 105.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.995 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 105.54 -132.66 11.22 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.501 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.71 74.9 0.18 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.834 0.349 . . . . 0.0 110.916 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.437 ' HB1' ' O ' ' A' ' 103' ' ' LEU . . . -120.09 121.18 38.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.033 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.128 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.921 179.967 . . . . . . . . 1 1 . 1 stop_ save_